elements
listlengths
1
9
nsites
int32
1
444
chemical_formula_anonymous
stringlengths
1
18
chemical_formula_reduced
stringlengths
1
23
chemical_formula_descriptive
stringlengths
1
34
nelements
int8
1
9
dimension_types
listlengths
3
3
nperiodic_dimensions
int8
3
3
lattice_vectors
listlengths
3
3
immutable_id
stringlengths
5
12
cartesian_site_positions
listlengths
1
444
species
stringlengths
138
1.25k
species_at_sites
listlengths
1
444
last_modified
stringdate
2011-05-12 00:00:00
2025-04-16 00:00:00
elements_ratios
listlengths
1
9
stress_tensor
listlengths
3
3
energy
float64
-2,420.44
2.57
energy_corrected
float64
-2,475.88
2.57
forces
listlengths
1
444
functional
stringclasses
1 value
cross_compatibility
bool
1 class
space_group_it_number
int32
1
230
id
stringlengths
13
21
relaxation_step
int32
0
741
relaxation_number
int32
0
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36627029, 7.55146797, -0.04096135 ], [ -3.36627029, 7.55146797, -0.04096135 ], [ 0, 4.14497059, 6.1116349 ] ]
agm005266151
[ [ 1.683135145, 3.775733985, -0.020480675 ], [ -1.683135145, 5.84821928, 3.035336775 ], [ 0.824779679599444, 3.925324547078546, 2.7076418081037943 ], [ 0.8247796795994433, 13.250096687921452, 0.2662529418962055 ], [ -0.8247796795994433, 15.322581982921452, 3.322070391896206 ], [ -0.824779679599444, 5.997809842078546, 5.7634592581037944 ], [ -2.5122220347609043, 10.899594714927497, 3.9837642938867326 ], [ -2.512222034760905, 10.420797110072503, 5.101765356113268 ], [ 2.512222034760905, 8.348311815072503, 2.0459479061132675 ], [ 2.5122220347609043, 8.827109419927497, 0.9279468438867325 ], [ -1.874017784996602, 10.80951764639505, 1.7865437689337609 ], [ -1.8740177849966022, 6.365903588604949, 1.1873509810662395 ], [ 1.8740177849966022, 8.438388883604949, 4.24316843106624 ], [ 1.874017784996602, 12.88200294139505, 4.84236121893376 ], [ 0.19660681431123272, 4.995700918965583, 2.490140602314752 ], [ 0.19660681431123272, 12.179720316034416, 0.483754147685248 ], [ -0.19660681431123272, 14.252205611034416, 3.5395715976852484 ], [ -0.19660681431123272, 7.068186213965582, 5.545958052314752 ], [ -0.9217676493138371, 13.920002576236135, 5.821692214543098 ], [ -0.921767649313837, 7.400389248763866, 3.263837435456902 ], [ 0.921767649313837, 5.327903953763866, 0.2080199854569025 ], [ 0.9217676493138371, 11.847517281236135, 2.7658747645430974 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.11107929, 0, 0 ], [ 0, 0.25862348, 0.15268629 ], [ 0, 0.15268629, -0.09803575 ] ]
-146.935101
-158.455101
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00122339, 0.00096383, -0.00255152 ], [ -0.00122339, -0.00096383, 0.00255152 ], [ 0.00122339, -0.00096383, 0.00255152 ], [ 0.00122339, 0.00096383, -0.00255152 ], [ -0.00115502, -0.00401313, 0.01109268 ], [ -0.00115502, 0.00401313, -0.01109268 ], [ 0.00115502, 0.00401313, -0.01109268 ], [ 0.00115502, -0.00401313, 0.01109268 ], [ 0.00101468, -0.00327298, 0.0015193 ], [ 0.00101468, 0.00327298, -0.0015193 ], [ -0.00101468, 0.00327298, -0.0015193 ], [ -0.00101468, -0.00327298, 0.0015193 ], [ -0.00351289, -0.00100185, 0.00119662 ], [ -0.00351289, 0.00100185, -0.00119662 ], [ 0.00351289, 0.00100185, -0.00119662 ], [ 0.00351289, -0.00100185, 0.00119662 ], [ 0.00585428, -0.00474784, -0.00105085 ], [ 0.00585428, 0.00474784, 0.00105085 ], [ -0.00585428, 0.00474784, 0.00105085 ], [ -0.00585428, -0.00474784, -0.00105085 ] ]
pbe
true
15
agm005266151-pbe-319
319
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.56214932, 7.1297648, -0.00299005 ], [ -3.56214932, 7.1297648, -0.00299005 ], [ 0, 3.94896741, 6.10916163 ] ]
agm005266151
[ [ 1.78107466, 3.5648824, -0.001495025 ], [ -1.78107466, 5.539366105, 3.05308579 ], [ 0.7947773522041951, 3.7427913820660064, 2.6918417814659574 ], [ 0.7947773522041954, 12.491221922933995, 0.3567589335340427 ], [ -0.7947773522041954, 14.465705627933994, 3.4113397485340426 ], [ -0.7947773522041951, 5.717275087066007, 5.746422596465957 ], [ -2.7403908239863966, 10.330749943076023, 4.02020760548865 ], [ -2.740390823986397, 9.852230771923978, 5.137554739511349 ], [ 2.740390823986397, 7.877747066923977, 2.082973924511349 ], [ 2.7403908239863966, 8.356266238076024, 0.9656267904886505 ], [ -2.0385734221050207, 10.218620058527597, 1.8488149641297966 ], [ -2.0385734221050202, 6.015393246472402, 1.1997857508702034 ], [ 2.0385734221050202, 7.989876951472402, 4.254366565870203 ], [ 2.0385734221050207, 12.193103763527597, 4.903395779129796 ], [ 0.10598299012927281, 4.766420879494836, 2.426117516282103 ], [ 0.10598299012927281, 11.467592425505165, 0.6224831987178974 ], [ -0.10598299012927281, 13.442076130505164, 3.677064013717897 ], [ -0.10598299012927281, 6.740904584494836, 5.4806983312821025 ], [ -1.1017568974900327, 13.051667720565634, 5.909008677102374 ], [ -1.101756897490033, 7.131312994434367, 3.2487536678976263 ], [ 1.101756897490033, 5.156829289434366, 0.1941728528976261 ], [ 1.1017568974900327, 11.077184015565635, 2.854427862102374 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -3.04809599, 0, 0 ], [ 0, -1.74524456, -1.3930455 ], [ 0, -1.39304555, -0.29882485 ] ]
-146.815885
-158.335885
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.07911446, 0.08926589, 0.00988295 ], [ -0.07911446, -0.08926589, -0.00988295 ], [ 0.07911446, -0.08926589, -0.00988295 ], [ 0.07911446, 0.08926589, 0.00988295 ], [ 0.03254537, -0.03642082, -0.06174685 ], [ 0.03254537, 0.03642082, 0.06174685 ], [ -0.03254537, 0.03642082, 0.06174685 ], [ -0.03254537, -0.03642082, -0.06174685 ], [ -0.00159943, 0.03928399, 0.00140164 ], [ -0.00159943, -0.03928399, -0.00140164 ], [ 0.00159943, -0.03928399, -0.00140164 ], [ 0.00159943, 0.03928399, 0.00140164 ], [ 0.10756042, -0.07641401, 0.0227011 ], [ 0.10756042, 0.07641401, -0.0227011 ], [ -0.10756042, 0.07641401, -0.0227011 ], [ -0.10756042, -0.07641401, 0.0227011 ], [ 0.06631949, -0.0032959, -0.01948169 ], [ 0.06631949, 0.0032959, 0.01948169 ], [ -0.06631949, 0.0032959, 0.01948169 ], [ -0.06631949, -0.0032959, -0.01948169 ] ]
pbe
true
15
agm005266151-pbe-32
32
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.3663295, 7.55181117, -0.04082758 ], [ -3.3663295, 7.55181117, -0.04082758 ], [ 0, 4.14526677, 6.11154954 ] ]
agm005266151
[ [ 1.68316475, 3.775905585, -0.02041379 ], [ -1.68316475, 5.84853897, 3.03536098 ], [ 0.824770555180755, 3.925512457236974, 2.707550495987148 ], [ 0.8247705551807551, 13.250743267763024, 0.26656911401285244 ], [ -0.8247705551807551, 15.323376652763026, 3.3223438840128527 ], [ -0.824770555180755, 5.998145842236974, 5.763325265987147 ], [ -2.5123027474107595, 10.900152205712123, 3.983890186596554 ], [ -2.5123027474107604, 10.421370289287875, 5.101778963403446 ], [ 2.5123027474107604, 8.348736904287875, 2.046004193403446 ], [ 2.5123027474107595, 8.827518820712124, 0.9281154165965539 ], [ -1.87409117708675, 10.810008985033122, 1.7867415822299817 ], [ -1.87409117708675, 6.366246739966878, 1.1873780277700186 ], [ 1.87409117708675, 8.438880124966879, 4.243152797770018 ], [ 1.87409117708675, 12.882642370033121, 4.842516352229982 ], [ 0.19650800337751995, 4.99588584405598, 2.49009852605135 ], [ 0.19650800337752017, 12.180369880944019, 0.4840210839486502 ], [ -0.19650800337752017, 14.253003265944018, 3.5397958539486507 ], [ -0.19650800337751995, 7.06851922905598, 5.54587329605135 ], [ -0.9216192152931504, 13.920756148870518, 5.821787402508829 ], [ -0.9216192152931499, 7.4007663461294815, 3.263881747491171 ], [ 0.9216192152931499, 5.328132961129482, 0.2081069774911714 ], [ 0.9216192152931504, 11.848122763870517, 2.766012632508829 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.08294695, 0, 0 ], [ 0, 0.14990169, 0.13663753 ], [ 0, 0.13663743, 0.05172292 ] ]
-146.93511
-158.45511
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00406025, 0.00251866, 0.0025437 ], [ -0.00406025, -0.00251866, -0.0025437 ], [ 0.00406025, -0.00251866, -0.0025437 ], [ 0.00406025, 0.00251866, 0.0025437 ], [ -0.00138174, 0.00074728, 0.00040792 ], [ -0.00138174, -0.00074728, -0.00040792 ], [ 0.00138174, -0.00074728, -0.00040792 ], [ 0.00138174, 0.00074728, 0.00040792 ], [ 0.00230635, -0.00375009, -0.00149025 ], [ 0.00230635, 0.00375009, 0.00149025 ], [ -0.00230635, 0.00375009, 0.00149025 ], [ -0.00230635, -0.00375009, -0.00149025 ], [ -0.00196477, -0.0024506, 0.0007905 ], [ -0.00196477, 0.0024506, -0.0007905 ], [ 0.00196477, 0.0024506, -0.0007905 ], [ 0.00196477, -0.0024506, 0.0007905 ], [ 0.00460213, -0.00268275, -0.00087004 ], [ 0.00460213, 0.00268275, 0.00087004 ], [ -0.00460213, 0.00268275, 0.00087004 ], [ -0.00460213, -0.00268275, -0.00087004 ] ]
pbe
true
15
agm005266151-pbe-320
320
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36637766, 7.55209028, -0.0407188 ], [ -3.36637766, 7.55209028, -0.0407188 ], [ 0, 4.14550764, 6.11148012 ] ]
agm005266151
[ [ 1.68318883, 3.77604514, -0.0203594 ], [ -1.68318883, 5.84879896, 3.0353806600000004 ], [ 0.8247631663117554, 3.9256652209496847, 2.707476158494371 ], [ 0.824763166311755, 13.251269159050315, 0.26682630150562925 ], [ -0.824763166311755, 15.324022979050316, 3.3225663615056296 ], [ -0.8247631663117554, 5.998419040949685, 5.763216218494371 ], [ -2.5123683471639096, 10.90060554077826, 3.9839925525946955 ], [ -2.5123683471639096, 10.42183647922174, 5.101790027405305 ], [ 2.5123683471639096, 8.34908265922174, 2.0460499674053043 ], [ 2.5123683471639096, 8.827851720778261, 0.9282524925946957 ], [ -1.874150878063128, 10.810408414737473, 1.7869024502241437 ], [ -1.874150878063128, 6.366525965262524, 1.1874000097758566 ], [ 1.874150878063128, 8.439279785262524, 4.2431400697758574 ], [ 1.874150878063128, 12.883162234737473, 4.8426425102241435 ], [ 0.1964276651681277, 4.996036245898714, 2.490064268674314 ], [ 0.19642766516812715, 12.180898134101284, 0.484238191325686 ], [ -0.19642766516812715, 14.253651954101285, 3.539978251325686 ], [ -0.1964276651681277, 7.068790065898714, 5.545804328674315 ], [ -0.9214984858275472, 13.92136896658964, 5.821864809284041 ], [ -0.9214984858275472, 7.40107305341036, 3.26391777071596 ], [ 0.9214984858275472, 5.32831923341036, 0.2081777107159596 ], [ 0.9214984858275472, 11.84861514658964, 2.7661247492840406 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.08044579, 0, 0 ], [ 0, 0.08888461, 0.12375713 ], [ 0, 0.12375716, 0.1890803 ] ]
-146.935114
-158.455114
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00622817, 0.00358059, 0.00676752 ], [ -0.00622817, -0.00358059, -0.00676752 ], [ 0.00622817, -0.00358059, -0.00676752 ], [ 0.00622817, 0.00358059, 0.00676752 ], [ -0.00154217, 0.00456529, -0.00828781 ], [ -0.00154217, -0.00456529, 0.00828781 ], [ 0.00154217, -0.00456529, 0.00828781 ], [ 0.00154217, 0.00456529, -0.00828781 ], [ 0.00342774, -0.00427693, -0.00418993 ], [ 0.00342774, 0.00427693, 0.00418993 ], [ -0.00342774, 0.00427693, 0.00418993 ], [ -0.00342774, -0.00427693, -0.00418993 ], [ -0.00152191, -0.00377314, 0.00001596 ], [ -0.00152191, 0.00377314, -0.00001596 ], [ 0.00152191, 0.00377314, -0.00001596 ], [ 0.00152191, -0.00377314, 0.00001596 ], [ 0.00445064, -0.00050478, -0.00053426 ], [ 0.00445064, 0.00050478, 0.00053426 ], [ -0.00445064, 0.00050478, 0.00053426 ], [ -0.00445064, -0.00050478, -0.00053426 ] ]
pbe
true
15
agm005266151-pbe-321
321
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36643711, 7.55238606, -0.0405675 ], [ -3.36643711, 7.55238606, -0.0405675 ], [ 0, 4.14579258, 6.11150559 ] ]
agm005266151
[ [ 1.683218555, 3.77619303, -0.02028375 ], [ -1.683218555, 5.84908932, 3.035469045 ], [ 0.824721848717025, 3.925866244213272, 2.7075021796746253 ], [ 0.8247218487170249, 13.251802165786728, 0.26711561532537487 ], [ -0.8247218487170249, 15.324698455786729, 3.322868410325375 ], [ -0.824721848717025, 5.998762534213272, 5.763254974674625 ], [ -2.5124497798902405, 10.901134316553387, 3.9841507295217076 ], [ -2.512449779890241, 10.422326673446612, 5.101972655478293 ], [ 2.512449779890241, 8.349430383446613, 2.0462198604782924 ], [ 2.5124497798902405, 8.828238026553386, 0.9283979345217078 ], [ -1.8741936707787565, 10.810818008894646, 1.787117067386138 ], [ -1.8741936707787565, 6.366850401105355, 1.187500727613862 ], [ 1.8741936707787565, 8.439746691105356, 4.243253522613862 ], [ 1.8741936707787565, 12.883714298894645, 4.842869862386139 ], [ 0.19634441464735097, 4.996193832997565, 2.49009133880189 ], [ 0.19634441464735097, 12.181474577002435, 0.4845264561981102 ], [ -0.19634441464735097, 14.254370867002436, 3.5402792511981103 ], [ -0.19634441464735097, 7.069090122997565, 5.54584413380189 ], [ -0.9213629667787013, 13.922042068097838, 5.822086031387928 ], [ -0.9213629667787014, 7.401418921902163, 3.264037353612072 ], [ 0.9213629667787014, 5.328522631902162, 0.20828455861207198 ], [ 0.9213629667787013, 11.849145778097839, 2.766333236387928 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.05114383, 0, 0 ], [ 0, -0.00314492, 0.09013678 ], [ 0, 0.09013672, 0.16740324 ] ]
-146.935119
-158.455119
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00535105, 0.00221118, 0.00583527 ], [ -0.00535105, -0.00221118, -0.00583527 ], [ 0.00535105, -0.00221118, -0.00583527 ], [ 0.00535105, 0.00221118, 0.00583527 ], [ -0.00159468, 0.00283263, -0.00442307 ], [ -0.00159468, -0.00283263, 0.00442307 ], [ 0.00159468, -0.00283263, 0.00442307 ], [ 0.00159468, 0.00283263, -0.00442307 ], [ 0.00234798, -0.00265256, -0.00400965 ], [ 0.00234798, 0.00265256, 0.00400965 ], [ -0.00234798, 0.00265256, 0.00400965 ], [ -0.00234798, -0.00265256, -0.00400965 ], [ -0.0013022, -0.00346092, -0.000605 ], [ -0.0013022, 0.00346092, 0.000605 ], [ 0.0013022, 0.00346092, 0.000605 ], [ 0.0013022, -0.00346092, -0.000605 ], [ 0.00298112, 0.00163137, -0.000089 ], [ 0.00298112, -0.00163137, 0.000089 ], [ -0.00298112, -0.00163137, 0.000089 ], [ -0.00298112, 0.00163137, -0.000089 ] ]
pbe
true
15
agm005266151-pbe-322
322
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36656386, 7.55301672, -0.0402449 ], [ -3.36656386, 7.55301672, -0.0402449 ], [ 0, 4.14640011, 6.11155991 ] ]
agm005266151
[ [ 1.68328193, 3.77650836, -0.02012245 ], [ -1.68328193, 5.849708415, 3.035657505 ], [ 0.8246337913576905, 3.9262948752064255, 2.707557624920964 ], [ 0.8246337913576904, 13.252938619793573, 0.2677325300790363 ], [ -0.8246337913576904, 15.326138674793572, 3.3235124850790365 ], [ -0.8246337913576905, 5.999494930206426, 5.7633375799209645 ], [ -2.512623322265683, 10.902261826963548, 3.9844881104386487 ], [ -2.512623322265683, 10.423371778036453, 5.102361954561352 ], [ 2.512623322265683, 8.350171723036453, 2.0465819995613517 ], [ 2.512623322265683, 8.829061771963547, 0.9287081554386485 ], [ -1.874284940566258, 10.811691353470856, 1.7875747584458626 ], [ -1.8742849405662578, 6.367542141529142, 1.1877153965541376 ], [ 1.8742849405662578, 8.440742196529143, 4.243495351554138 ], [ 1.874284940566258, 12.884891408470857, 4.843354713445863 ], [ 0.19616691553983479, 4.996529867974589, 2.4901489598264517 ], [ 0.1961669155398349, 12.18270362702541, 0.48514119517354826 ], [ -0.1961669155398349, 14.255903682025409, 3.5409211501735487 ], [ -0.19616691553983479, 7.069729922974589, 5.545928914826452 ], [ -0.9210740293075419, 13.923477373176404, 5.822557847845613 ], [ -0.9210740293075419, 7.4021562318235965, 3.264292217154388 ], [ 0.9210740293075419, 5.3289561768235965, 0.20851226215438773 ], [ 0.9210740293075419, 11.850277318176403, 2.7667778928456124 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.05300494, 0, 0 ], [ 0, -0.245733, 0.017036 ], [ 0, 0.01703603, 0.06970209 ] ]
-146.935124
-158.455124
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00306165, -0.00070956, 0.00369938 ], [ -0.00306165, 0.00070956, -0.00369938 ], [ 0.00306165, 0.00070956, -0.00369938 ], [ 0.00306165, -0.00070956, 0.00369938 ], [ -0.00145239, -0.0010242, 0.00431874 ], [ -0.00145239, 0.0010242, -0.00431874 ], [ 0.00145239, 0.0010242, -0.00431874 ], [ 0.00145239, -0.0010242, 0.00431874 ], [ -0.00031085, 0.00137885, -0.00303947 ], [ -0.00031085, -0.00137885, 0.00303947 ], [ 0.00031085, -0.00137885, 0.00303947 ], [ 0.00031085, 0.00137885, -0.00303947 ], [ -0.00018564, -0.00279805, -0.00178155 ], [ -0.00018564, 0.00279805, 0.00178155 ], [ 0.00018564, 0.00279805, 0.00178155 ], [ 0.00018564, -0.00279805, -0.00178155 ], [ -0.00070636, 0.0063972, 0.00076733 ], [ -0.00070636, -0.0063972, -0.00076733 ], [ 0.00070636, -0.0063972, -0.00076733 ], [ 0.00070636, 0.0063972, 0.00076733 ] ]
pbe
true
15
agm005266151-pbe-323
323
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36654158, 7.55290586, -0.0403016 ], [ -3.36654158, 7.55290586, -0.0403016 ], [ 0, 4.14629332, 6.11155036 ] ]
agm005266151
[ [ 1.68327079, 3.77645293, -0.0201508 ], [ -1.68327079, 5.84959959, 3.03562438 ], [ 0.8246492738001993, 3.92621946814873, 2.707547916372015 ], [ 0.8246492738001994, 13.252738911851269, 0.2676240636279852 ], [ -0.8246492738001994, 15.32588557185127, 3.3233992436279847 ], [ -0.8246492738001993, 5.99936612814873, 5.763323096372015 ], [ -2.5125927898478237, 10.902063613740873, 3.9844288114525956 ], [ -2.5125927898478233, 10.423188086259128, 5.102293528547404 ], [ 2.5125927898478233, 8.350041426259128, 2.0465183485474037 ], [ 2.5125927898478237, 8.828916953740874, 0.9286536314525964 ], [ -1.8742689006388673, 10.811537841843998, 1.7874943423730387 ], [ -1.8742689006388675, 6.367420538156, 1.187677637626961 ], [ 1.8742689006388675, 8.440567198156, 4.24345281762696 ], [ 1.8742689006388673, 12.884684501844, 4.843269522373038 ], [ 0.1961981044287514, 4.9964707991355075, 2.490138835630115 ], [ 0.1961981044287513, 12.182487580864494, 0.4850331443698848 ], [ -0.1961981044287513, 14.255634240864493, 3.540808324369885 ], [ -0.1961981044287514, 7.069617459135507, 5.545914015630115 ], [ -0.9211248281703281, 13.923225011722396, 5.822474886463773 ], [ -0.9211248281703278, 7.402026688277605, 3.2642474535362265 ], [ 0.9211248281703278, 5.328880028277604, 0.2084722735362264 ], [ 0.9211248281703281, 11.850078351722397, 2.7666997064637733 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.03544182, 0, 0 ], [ 0, -0.19452851, 0.03234183 ], [ 0, 0.03234183, 0.0848618 ] ]
-146.935124
-158.455124
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00345707, -0.00015142, 0.00408927 ], [ -0.00345707, 0.00015142, -0.00408927 ], [ 0.00345707, 0.00015142, -0.00408927 ], [ 0.00345707, -0.00015142, 0.00408927 ], [ -0.00141965, -0.00032699, 0.0027797 ], [ -0.00141965, 0.00032699, -0.0027797 ], [ 0.00141965, 0.00032699, -0.0027797 ], [ 0.00141965, -0.00032699, 0.0027797 ], [ 0.00029025, 0.00075905, -0.00355828 ], [ 0.00029025, -0.00075905, 0.00355828 ], [ -0.00029025, -0.00075905, 0.00355828 ], [ -0.00029025, 0.00075905, -0.00355828 ], [ -0.00048141, -0.00287518, -0.00163249 ], [ -0.00048141, 0.00287518, 0.00163249 ], [ 0.00048141, 0.00287518, 0.00163249 ], [ 0.00048141, -0.00287518, -0.00163249 ], [ -0.00028041, 0.00585741, 0.00061231 ], [ -0.00028041, -0.00585741, -0.00061231 ], [ 0.00028041, -0.00585741, -0.00061231 ], [ 0.00028041, 0.00585741, 0.00061231 ] ]
pbe
true
15
agm005266151-pbe-324
324
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36655135, 7.55289048, -0.04023701 ], [ -3.36655135, 7.55289048, -0.04023701 ], [ 0, 4.14633744, 6.11160591 ] ]
agm005266151
[ [ 1.683275675, 3.77644524, -0.020118505 ], [ -1.683275675, 5.84961396, 3.0356844499999998 ], [ 0.8246058145755935, 3.9262313943483913, 2.7076157192026415 ], [ 0.8246058145755932, 13.25271828565161, 0.26771321579735835 ], [ -0.8246058145755932, 15.32588700565161, 3.3235161707973586 ], [ -0.8246058145755935, 5.999400114348391, 5.763418674202642 ], [ -2.5126233444830954, 10.902079855050507, 3.9845512735336683 ], [ -2.5126233444830954, 10.423207264949493, 5.102383571466331 ], [ 2.5126233444830954, 8.350038544949493, 2.0465806164663314 ], [ 2.5126233444830954, 8.828911135050507, 0.9287483185336687 ], [ -1.8742749459114398, 10.811522070201471, 1.7875682369762929 ], [ -1.87427494591144, 6.36742760979853, 1.187760698023707 ], [ 1.87427494591144, 8.44059632979853, 4.243563653023706 ], [ 1.8742749459114398, 12.884690790201471, 4.843371191976293 ], [ 0.19616780253704091, 4.9964310435700945, 2.4901610069521762 ], [ 0.19616780253704125, 12.182518636429906, 0.4851679280478235 ], [ -0.19616780253704125, 14.255687356429906, 3.540970883047823 ], [ -0.19616780253704091, 7.0695997635700945, 5.545963961952176 ], [ -0.9210826588916781, 13.92329864099122, 5.822617595756894 ], [ -0.9210826588916782, 7.4019884790087795, 3.264317249243106 ], [ 0.9210826588916782, 5.32881975900878, 0.2085142942431057 ], [ 0.9210826588916781, 11.850129920991222, 2.7668146407568943 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.03094335, 0, 0 ], [ 0, -0.15005273, -0.01739017 ], [ 0, -0.01739019, 0.07592323 ] ]
-146.935127
-158.455127
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00110358, -0.00234242, 0.00193318 ], [ -0.00110358, 0.00234242, -0.00193318 ], [ 0.00110358, 0.00234242, -0.00193318 ], [ 0.00110358, -0.00234242, 0.00193318 ], [ -0.00134059, 0.00039096, 0.00037323 ], [ -0.00134059, -0.00039096, -0.00037323 ], [ 0.00134059, -0.00039096, -0.00037323 ], [ 0.00134059, 0.00039096, 0.00037323 ], [ -0.00102113, 0.00152645, -0.00124264 ], [ -0.00102113, -0.00152645, 0.00124264 ], [ 0.00102113, -0.00152645, 0.00124264 ], [ 0.00102113, 0.00152645, -0.00124264 ], [ -0.00153412, -0.00150405, -0.00165459 ], [ -0.00153412, 0.00150405, 0.00165459 ], [ 0.00153412, 0.00150405, 0.00165459 ], [ 0.00153412, -0.00150405, -0.00165459 ], [ 0.00037115, 0.00550804, 0.00075024 ], [ 0.00037115, -0.00550804, -0.00075024 ], [ -0.00037115, -0.00550804, -0.00075024 ], [ -0.00037115, 0.00550804, 0.00075024 ] ]
pbe
true
15
agm005266151-pbe-325
325
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36657062, 7.55286013, -0.0401096 ], [ -3.36657062, 7.55286013, -0.0401096 ], [ 0, 4.14642446, 6.11171549 ] ]
agm005266151
[ [ 1.68328531, 3.776430065, -0.0200548 ], [ -1.68328531, 5.849642295000001, 3.035802945 ], [ 0.8245200411667366, 3.926254856903638, 2.707749547585026 ], [ 0.8245200411667364, 13.252677633096363, 0.26788899741497385 ], [ -0.8245200411667364, 15.325889863096362, 3.323746742414974 ], [ -0.8245200411667366, 5.999467086903638, 5.763607292585026 ], [ -2.5126835119951165, 10.902112031144206, 3.9847929136319253 ], [ -2.512683511995117, 10.423244918855794, 5.102561121368074 ], [ 2.512683511995117, 8.350032688855794, 2.046703376368075 ], [ 2.5126835119951165, 8.828899801144207, 0.9289351686319254 ], [ -1.874286886148751, 10.811491216987243, 1.787714121140337 ], [ -1.8742868861487512, 6.367441273012756, 1.1879244238596631 ], [ 1.8742868861487512, 8.440653503012756, 4.243782168859663 ], [ 1.874286886148751, 12.884703446987244, 4.843571866140337 ], [ 0.1961079231337548, 4.996352613771984, 2.4902046791364096 ], [ 0.1961079231337548, 12.182579876228015, 0.48543386586359016 ], [ -0.1961079231337548, 14.255792106228014, 3.54129161086359 ], [ -0.1961079231337548, 7.069564843771985, 5.54606242413641 ], [ -0.9209994239889336, 13.923443789177263, 5.822899173524723 ], [ -0.9209994239889336, 7.401913160822737, 3.2644548614752766 ], [ 0.9209994239889336, 5.328700930822737, 0.208597116475277 ], [ 0.9209994239889336, 11.850231559177264, 2.767041428524723 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.0340833, 0, 0 ], [ 0, -0.06249639, -0.1151829 ], [ 0, -0.11518292, 0.05147401 ] ]
-146.93513
-158.45513
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00367428, -0.00670376, -0.00279613 ], [ 0.00367428, 0.00670376, 0.00279613 ], [ -0.00367428, 0.00670376, 0.00279613 ], [ -0.00367428, -0.00670376, -0.00279613 ], [ -0.00102267, 0.00191253, -0.00461323 ], [ -0.00102267, -0.00191253, 0.00461323 ], [ 0.00102267, -0.00191253, 0.00461323 ], [ 0.00102267, 0.00191253, -0.00461323 ], [ -0.00354692, 0.0032259, 0.00347583 ], [ -0.00354692, -0.0032259, -0.00347583 ], [ 0.00354692, -0.0032259, -0.00347583 ], [ 0.00354692, 0.0032259, 0.00347583 ], [ -0.00338811, 0.00125069, -0.00197625 ], [ -0.00338811, -0.00125069, 0.00197625 ], [ 0.00338811, -0.00125069, 0.00197625 ], [ 0.00338811, 0.00125069, -0.00197625 ], [ 0.00120155, 0.00454963, 0.00088758 ], [ 0.00120155, -0.00454963, -0.00088758 ], [ -0.00120155, -0.00454963, -0.00088758 ], [ -0.00120155, 0.00454963, 0.00088758 ] ]
pbe
true
15
agm005266151-pbe-326
326
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36657374, 7.55283609, -0.04009229 ], [ -3.36657374, 7.55283609, -0.04009229 ], [ 0, 4.14642543, 6.11174769 ] ]
agm005266151
[ [ 1.68328687, 3.776418045, -0.020046145 ], [ -1.68328687, 5.84963076, 3.0358277 ], [ 0.8245024911370528, 3.92622392152656, 2.707776195941685 ], [ 0.8245024911370531, 13.252660973473438, 0.2679130690583143 ], [ -0.8245024911370531, 15.325873688473438, 3.3237869140583145 ], [ -0.8245024911370528, 5.999436636526561, 5.763650040941685 ], [ -2.5127046934604027, 10.902095601836157, 3.984828149933672 ], [ -2.5127046934604023, 10.423214723163841, 5.102608805066327 ], [ 2.5127046934604023, 8.350002008163841, 2.0467349600663276 ], [ 2.5127046934604027, 8.828882886836157, 0.9289543049336721 ], [ -1.8743008438238786, 10.811465502571043, 1.7877409805263156 ], [ -1.8743008438238786, 6.367419392428955, 1.1879482844736842 ], [ 1.8743008438238786, 8.440632107428955, 4.243822129473684 ], [ 1.8743008438238786, 12.884678217571043, 4.843614825526315 ], [ 0.19607622342524178, 4.9963125224633815, 2.490199656308585 ], [ 0.196076223425242, 12.182572372536617, 0.48548960869141516 ], [ -0.196076223425242, 14.255785087536617, 3.5413634536914147 ], [ -0.19607622342524178, 7.069525237463381, 5.546073501308585 ], [ -0.9209664098017187, 13.923462514699294, 5.822958714435972 ], [ -0.9209664098017183, 7.401847810300705, 3.264478240564028 ], [ 0.9209664098017183, 5.328635095300705, 0.208604395564028 ], [ 0.9209664098017187, 11.850249799699293, 2.7670848694359718 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.00267081, 0, 0 ], [ 0, -0.00744924, -0.11178366 ], [ 0, -0.11178365, 0.06781135 ] ]
-146.935132
-158.455132
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00365309, -0.00615642, -0.00392624 ], [ 0.00365309, 0.00615642, 0.00392624 ], [ -0.00365309, 0.00615642, 0.00392624 ], [ -0.00365309, -0.00615642, -0.00392624 ], [ -0.00100159, 0.00091759, -0.00278031 ], [ -0.00100159, -0.00091759, 0.00278031 ], [ 0.00100159, -0.00091759, 0.00278031 ], [ 0.00100159, 0.00091759, -0.00278031 ], [ -0.00349155, 0.00292148, 0.00340421 ], [ -0.00349155, -0.00292148, -0.00340421 ], [ 0.00349155, -0.00292148, -0.00340421 ], [ 0.00349155, 0.00292148, 0.00340421 ], [ -0.00373695, 0.00131125, -0.00157361 ], [ -0.00373695, -0.00131125, 0.00157361 ], [ 0.00373695, -0.00131125, 0.00157361 ], [ 0.00373695, 0.00131125, -0.00157361 ], [ 0.0011819, 0.00418481, 0.00094619 ], [ 0.0011819, -0.00418481, -0.00094619 ], [ -0.0011819, -0.00418481, -0.00094619 ], [ -0.0011819, 0.00418481, 0.00094619 ] ]
pbe
true
15
agm005266151-pbe-327
327
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.3665831, 7.55276396, -0.04004039 ], [ -3.3665831, 7.55276396, -0.04004039 ], [ 0, 4.14642835, 6.11184428 ] ]
agm005266151
[ [ 1.68329155, 3.77638198, -0.020020195 ], [ -1.68329155, 5.849596155, 3.035901945 ], [ 0.8244498745101579, 3.9261313448214703, 2.707856126742918 ], [ 0.824449874510158, 13.252610750178528, 0.26798523325708173 ], [ -0.824449874510158, 15.325824925178528, 3.323907373257082 ], [ -0.8244498745101579, 5.99934551982147, 5.763778266742918 ], [ -2.512768305397585, 10.90204630921632, 3.9849338198382593 ], [ -2.512768305397585, 10.423124135783679, 5.10275182016174 ], [ 2.512768305397585, 8.34990996078368, 2.0468296801617405 ], [ 2.512768305397585, 8.82883213421632, 0.9290116798382596 ], [ -1.8743427843168297, 10.811388266438653, 1.7878213953624131 ], [ -1.87434278431683, 6.367353828561346, 1.1880199646375866 ], [ 1.87434278431683, 8.440568003561346, 4.243942104637586 ], [ 1.8743427843168297, 12.884602441438654, 4.843743535362413 ], [ 0.195981123945146, 4.996192550815267, 2.4901845670556675 ], [ 0.19598112394514633, 12.182549544184734, 0.48565679294433234 ], [ -0.19598112394514633, 14.255763719184735, 3.5415789329443323 ], [ -0.195981123945146, 7.069406725815266, 5.546106707055667 ], [ -0.9208672995317628, 13.923518768931363, 5.823137411950461 ], [ -0.920867299531763, 7.401651676068639, 3.2645482280495384 ], [ 0.920867299531763, 5.328437501068638, 0.2086260880495387 ], [ 0.9208672995317628, 11.850304593931362, 2.767215271950461 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.00769293, 0, 0 ], [ 0, 0.04382742, -0.10403816 ], [ 0, -0.10403812, 0.01387036 ] ]
-146.935136
-158.455136
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00350066, -0.00425449, -0.00690543 ], [ 0.00350066, 0.00425449, 0.00690543 ], [ -0.00350066, 0.00425449, 0.00690543 ], [ -0.00350066, -0.00425449, -0.00690543 ], [ -0.00081726, -0.00217075, 0.00307171 ], [ -0.00081726, 0.00217075, -0.00307171 ], [ 0.00081726, 0.00217075, -0.00307171 ], [ 0.00081726, -0.00217075, 0.00307171 ], [ -0.0032414, 0.00181248, 0.00459362 ], [ -0.0032414, -0.00181248, -0.00459362 ], [ 0.0032414, -0.00181248, -0.00459362 ], [ 0.0032414, 0.00181248, 0.00459362 ], [ -0.00392564, 0.00104687, -0.00099491 ], [ -0.00392564, -0.00104687, 0.00099491 ], [ 0.00392564, -0.00104687, 0.00099491 ], [ 0.00392564, 0.00104687, -0.00099491 ], [ 0.00245844, 0.00232936, 0.00086597 ], [ 0.00245844, -0.00232936, -0.00086597 ], [ -0.00245844, -0.00232936, -0.00086597 ], [ -0.00245844, 0.00232936, 0.00086597 ] ]
pbe
true
15
agm005266151-pbe-328
328
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36660182, 7.55261972, -0.03993657 ], [ -3.36660182, 7.55261972, -0.03993657 ], [ 0, 4.1464342, 6.11203748 ] ]
agm005266151
[ [ 1.68330091, 3.77630986, -0.019968285 ], [ -1.68330091, 5.84952696, 3.036050455 ], [ 0.8243446403403993, 3.9259460140208575, 2.7080159408649274 ], [ 0.8243446403403993, 13.252510525979142, 0.2681296591350722 ], [ -0.8243446403403993, 15.325727625979141, 3.3241483991350718 ], [ -0.8243446403403993, 5.999163114020858, 5.764034680864928 ], [ -2.512895530216562, 10.901947901135085, 3.9851451938362374 ], [ -2.5128955302165616, 10.422942838864916, 5.103037886163762 ], [ 2.5128955302165616, 8.349725738864915, 2.047019146163762 ], [ 2.512895530216562, 8.828730801135084, 0.9291264538362376 ], [ -1.8744266659154385, 10.81123405513707, 1.7879823774121948 ], [ -1.874426665915438, 6.3672224848629275, 1.1881632225878052 ], [ 1.874426665915438, 8.440439584862927, 4.244181962587805 ], [ 1.8744266659154385, 12.884451155137072, 4.844001117412194 ], [ 0.19579085605741242, 4.995952471196871, 2.4901543973955214 ], [ 0.1957908560574122, 12.182504068803128, 0.4859912026044788 ], [ -0.1957908560574122, 14.25572116880313, 3.5420099426044787 ], [ -0.19579085605741242, 7.06916957119687, 5.546173137395521 ], [ -0.9206691109618388, 13.92363107900797, 5.8234948610581645 ], [ -0.9206691109618388, 7.401259660992029, 3.2646882189418354 ], [ 0.9206691109618388, 5.32804256099203, 0.20866947894183538 ], [ 0.9206691109618388, 11.850413979007971, 2.767476121058164 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.07641927, 0, 0 ], [ 0, 0.26443146, -0.08836944 ], [ 0, -0.08836946, 0.01471265 ] ]
-146.935136
-158.455136
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00302824, -0.00112606, -0.01311828 ], [ 0.00302824, 0.00112606, 0.01311828 ], [ -0.00302824, 0.00112606, 0.01311828 ], [ -0.00302824, -0.00112606, -0.01311828 ], [ -0.00032463, -0.00847163, 0.01470849 ], [ -0.00032463, 0.00847163, -0.01470849 ], [ 0.00032463, 0.00847163, -0.01470849 ], [ 0.00032463, -0.00847163, 0.01470849 ], [ -0.00249476, -0.00033397, 0.00640405 ], [ -0.00249476, 0.00033397, -0.00640405 ], [ 0.00249476, 0.00033397, -0.00640405 ], [ 0.00249476, -0.00033397, 0.00640405 ], [ -0.00426249, 0.00138504, 0.0004229 ], [ -0.00426249, -0.00138504, -0.0004229 ], [ 0.00426249, -0.00138504, -0.0004229 ], [ 0.00426249, 0.00138504, 0.0004229 ], [ 0.00293545, -0.00210281, 0.00060188 ], [ 0.00293545, 0.00210281, -0.00060188 ], [ -0.00293545, 0.00210281, -0.00060188 ], [ -0.00293545, -0.00210281, 0.00060188 ] ]
pbe
true
15
agm005266151-pbe-329
329
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.55611613, 7.13376608, -0.00466443 ], [ -3.55611613, 7.13376608, -0.00466443 ], [ 0, 3.94974674, 6.10401474 ] ]
agm005266151
[ [ 1.778058065, 3.56688304, -0.002332215 ], [ -1.778058065, 5.54175641, 3.049675155 ], [ 0.7925564382110368, 3.74372200960895, 2.690584036178382 ], [ 0.792556438211037, 12.49868352039105, 0.352094473821618 ], [ -0.792556438211037, 14.47355689039105, 3.404101843821618 ], [ -0.7925564382110368, 5.718595379608951, 5.7425914061783825 ], [ -2.7357092215324808, 10.335184031220187, 4.015719444465531 ], [ -2.735709221532481, 9.856968238779814, 5.130973805534469 ], [ 2.735709221532481, 7.882094868779814, 2.07896643553447 ], [ 2.7357092215324808, 8.360310661220186, 0.9637120744655302 ], [ -2.034817259674518, 10.222794804291468, 1.8461829099548037 ], [ -2.0348172596745178, 6.019610725708532, 1.1964956000451965 ], [ 2.0348172596745178, 7.994484095708531, 4.248502970045196 ], [ 2.034817259674518, 12.197668174291469, 4.898190279954804 ], [ 0.10824600576636068, 4.767681149073867, 2.424523570679291 ], [ 0.10824600576636056, 11.474724380926133, 0.6181549393207096 ], [ -0.10824600576636056, 13.449597750926134, 3.67016230932071 ], [ -0.10824600576636068, 6.742554519073867, 5.47653094067929 ], [ -1.099057874088769, 13.059800454970595, 5.898724057117874 ], [ -1.099057874088769, 7.132351815029407, 3.247969192882126 ], [ 1.099057874088769, 5.157478445029407, 0.19596182288212619 ], [ 1.099057874088769, 11.084927084970595, 2.846716687117874 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.08493017, 0, 0 ], [ 0, 1.89807271, -2.87864195 ], [ 0, -2.87864193, 3.70022159 ] ]
-146.817228
-158.337228
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00123702, 0.0276577, -0.00358812 ], [ 0.00123702, -0.0276577, 0.00358812 ], [ -0.00123702, -0.0276577, 0.00358812 ], [ -0.00123702, 0.0276577, -0.00358812 ], [ 0.02373063, 0.02438362, -0.19438633 ], [ 0.02373063, -0.02438362, 0.19438633 ], [ -0.02373063, -0.02438362, 0.19438633 ], [ -0.02373063, 0.02438362, -0.19438633 ], [ 0.00827687, 0.02353172, -0.01952733 ], [ 0.00827687, -0.02353172, 0.01952733 ], [ -0.00827687, -0.02353172, 0.01952733 ], [ -0.00827687, 0.02353172, -0.01952733 ], [ 0.03363911, 0.01731918, 0.00791333 ], [ 0.03363911, -0.01731918, -0.00791333 ], [ -0.03363911, -0.01731918, -0.00791333 ], [ -0.03363911, 0.01731918, 0.00791333 ], [ 0.07547167, -0.02536595, -0.0154267 ], [ 0.07547167, 0.02536595, 0.0154267 ], [ -0.07547167, 0.02536595, 0.0154267 ], [ -0.07547167, -0.02536595, -0.0154267 ] ]
pbe
true
15
agm005266151-pbe-33
33
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36659338, 7.55268474, -0.03998337 ], [ -3.36659338, 7.55268474, -0.03998337 ], [ 0, 4.14643156, 6.11195039 ] ]
agm005266151
[ [ 1.68329669, 3.77634237, -0.019991685 ], [ -1.68329669, 5.84955815, 3.03598351 ], [ 0.8243920626483988, 3.926029559513262, 2.7079438890786274 ], [ 0.8243920626483985, 13.252555700486738, 0.2680645659213725 ], [ -0.8243920626483985, 15.325771480486736, 3.324039760921372 ], [ -0.8243920626483988, 5.999245339513262, 5.763919084078627 ], [ -2.5128381928846455, 10.90199225141197, 3.9850499383693494 ], [ -2.512838192884645, 10.42302456858803, 5.102908906630651 ], [ 2.512838192884645, 8.34980878858803, 2.0469337116306505 ], [ 2.5128381928846455, 8.82877647141197, 0.9290747433693495 ], [ -1.8743888394883264, 10.8113035680989, 1.7879098002468352 ], [ -1.8743888394883266, 6.367281691901102, 1.188098654753165 ], [ 1.8743888394883266, 8.440497471901102, 4.244073849753165 ], [ 1.8743888394883264, 12.8845193480989, 4.843884995246835 ], [ 0.19587661733624717, 4.996060721907992, 2.4901679939779973 ], [ 0.19587661733624717, 12.182524538092009, 0.4858404610220028 ], [ -0.19587661733624717, 14.255740318092009, 3.541815656022002 ], [ -0.19587661733624717, 7.069276501907992, 5.546143188977997 ], [ -0.920758441535533, 13.923580390567007, 5.823333703299761 ], [ -0.9207584415355328, 7.4014364294329935, 3.2646251417002383 ], [ 0.9207584415355328, 5.328220649432994, 0.20864994670023837 ], [ 0.920758441535533, 11.850364610567006, 2.767358508299761 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.0257439, 0, 0 ], [ 0, 0.15752718, -0.09259784 ], [ 0, -0.09259777, 0.00770588 ] ]
-146.935138
-158.455138
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00308875, -0.00244818, -0.01037046 ], [ 0.00308875, 0.00244818, 0.01037046 ], [ -0.00308875, 0.00244818, 0.01037046 ], [ -0.00308875, -0.00244818, -0.01037046 ], [ -0.00052407, -0.00568068, 0.0094821 ], [ -0.00052407, 0.00568068, -0.0094821 ], [ 0.00052407, 0.00568068, -0.0094821 ], [ 0.00052407, -0.00568068, 0.0094821 ], [ -0.00287823, 0.00052697, 0.00580655 ], [ -0.00287823, -0.00052697, -0.00580655 ], [ 0.00287823, -0.00052697, -0.00580655 ], [ 0.00287823, 0.00052697, 0.00580655 ], [ -0.00400817, 0.00115345, -0.00006113 ], [ -0.00400817, -0.00115345, 0.00006113 ], [ 0.00400817, -0.00115345, 0.00006113 ], [ 0.00400817, 0.00115345, -0.00006113 ], [ 0.00243153, -0.00078381, 0.00064357 ], [ 0.00243153, 0.00078381, -0.00064357 ], [ -0.00243153, 0.00078381, -0.00064357 ], [ -0.00243153, -0.00078381, 0.00064357 ] ]
pbe
true
15
agm005266151-pbe-330
330
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.3665995, 7.5526837, -0.03997868 ], [ -3.3665995, 7.5526837, -0.03997868 ], [ 0, 4.14643496, 6.11198302 ] ]
agm005266151
[ [ 1.68329975, 3.77634185, -0.01998934 ], [ -1.68329975, 5.84955933, 3.03600217 ], [ 0.824378916571045, 3.9259925174486803, 2.7079402713668537 ], [ 0.8243789165710451, 13.25259236255132, 0.2680938786331466 ], [ -0.8243789165710451, 15.325809842551319, 3.3240853886331463 ], [ -0.824378916571045, 5.9992099974486806, 5.763931781366853 ], [ -2.5128682460342997, 10.901988863487915, 3.985097028295857 ], [ -2.5128682460342997, 10.423030976512084, 5.102920141704144 ], [ 2.5128682460342997, 8.349813496512084, 2.0469286317041435 ], [ 2.5128682460342997, 8.828771383487915, 0.9291055182958563 ], [ -1.8744158467298548, 10.811310425024171, 1.7879357604935133 ], [ -1.874415846729855, 6.367274454975828, 1.1880983895064867 ], [ 1.874415846729855, 8.440491934975828, 4.244089899506487 ], [ 1.8744158467298548, 12.884527905024171, 4.843927270493514 ], [ 0.19582519511246999, 4.996026886009221, 2.4901504882849457 ], [ 0.19582519511246987, 12.182557993990779, 0.4858836617150545 ], [ -0.19582519511246987, 14.255775473990777, 3.5418751717150547 ], [ -0.19582519511246999, 7.069244366009221, 5.546141998284946 ], [ -0.92071022234213, 13.92364298763075, 5.8233804917104255 ], [ -0.9207102223421298, 7.40137685236925, 3.264636678289575 ], [ 0.9207102223421298, 5.32815937236925, 0.20864516828957522 ], [ 0.92071022234213, 11.85042550763075, 2.767388981710425 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.03459586, 0, 0 ], [ 0, 0.1734969, -0.0813759 ], [ 0, -0.08137587, 0.03925308 ] ]
-146.935141
-158.455141
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00190071, -0.00090657, -0.00889622 ], [ 0.00190071, 0.00090657, 0.00889622 ], [ -0.00190071, 0.00090657, 0.00889622 ], [ -0.00190071, -0.00090657, -0.00889622 ], [ -0.00048863, -0.00411171, 0.00556986 ], [ -0.00048863, 0.00411171, -0.00556986 ], [ 0.00048863, 0.00411171, -0.00556986 ], [ 0.00048863, -0.00411171, 0.00556986 ], [ -0.00204826, -0.00035634, 0.00486783 ], [ -0.00204826, 0.00035634, -0.00486783 ], [ 0.00204826, 0.00035634, -0.00486783 ], [ 0.00204826, -0.00035634, 0.00486783 ], [ -0.00389544, 0.0001905, 0.00000724 ], [ -0.00389544, -0.0001905, -0.00000724 ], [ 0.00389544, -0.0001905, -0.00000724 ], [ 0.00389544, 0.0001905, 0.00000724 ], [ 0.00342558, -0.00069788, 0.0007612 ], [ 0.00342558, 0.00069788, -0.0007612 ], [ -0.00342558, 0.00069788, -0.0007612 ], [ -0.00342558, -0.00069788, 0.0007612 ] ]
pbe
true
15
agm005266151-pbe-331
331
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36661784, 7.55268056, -0.03996459 ], [ -3.36661784, 7.55268056, -0.03996459 ], [ 0, 4.14644516, 6.11208089 ] ]
agm005266151
[ [ 1.68330892, 3.77634028, -0.019982295 ], [ -1.68330892, 5.84956286, 3.0360581499999997 ], [ 0.8243394394562041, 3.9258813930562377, 2.707929536048113 ], [ 0.824339439456204, 13.252702306943762, 0.2681817289518866 ], [ -0.824339439456204, 15.325924886943763, 3.3242221739518865 ], [ -0.8243394394562041, 5.999103973056238, 5.763969981048113 ], [ -2.5129583237781654, 10.901978678250131, 3.985238307696673 ], [ -2.512958323778166, 10.423050181749868, 5.1029538473033265 ], [ 2.512958323778166, 8.349827601749869, 2.046913402303327 ], [ 2.5129583237781654, 8.828756098250132, 0.9291978626966728 ], [ -1.8744969251658254, 10.811330887612725, 1.7880135389572995 ], [ -1.8744969251658254, 6.367252812387275, 1.1880977260427001 ], [ 1.8744969251658254, 8.440475392387276, 4.2441381710426995 ], [ 1.8744969251658254, 12.884553467612724, 4.844053983957299 ], [ 0.19567095981539107, 4.9959252109324686, 2.4900978476768083 ], [ 0.19567095981539095, 12.182658489067531, 0.48601341732319153 ], [ -0.19567095981539095, 14.25588106906753, 3.5420538623231907 ], [ -0.19567095981539107, 7.069147790932469, 5.546138292676808 ], [ -0.9205654908723986, 13.923830752480928, 5.823520865044589 ], [ -0.9205654908723984, 7.40119810751907, 3.2646712899554102 ], [ 0.9205654908723984, 5.3279755275190706, 0.2086308449554104 ], [ 0.9205654908723986, 11.850608172480928, 2.7674804200445897 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.06550948, 0, 0 ], [ 0, 0.24454318, -0.04326141 ], [ 0, -0.04326136, 0.14736601 ] ]
-146.935146
-158.455146
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00195464, 0.0031182, -0.00463668 ], [ -0.00195464, -0.0031182, 0.00463668 ], [ 0.00195464, -0.0031182, 0.00463668 ], [ 0.00195464, 0.0031182, -0.00463668 ], [ -0.00033385, 0.0005593, -0.00630814 ], [ -0.00033385, -0.0005593, 0.00630814 ], [ 0.00033385, -0.0005593, 0.00630814 ], [ 0.00033385, 0.0005593, -0.00630814 ], [ 0.00079725, -0.00312721, 0.00218018 ], [ 0.00079725, 0.00312721, -0.00218018 ], [ -0.00079725, 0.00312721, -0.00218018 ], [ -0.00079725, -0.00312721, 0.00218018 ], [ -0.00253944, -0.00161688, 0.00089341 ], [ -0.00253944, 0.00161688, -0.00089341 ], [ 0.00253944, 0.00161688, -0.00089341 ], [ 0.00253944, -0.00161688, 0.00089341 ], [ 0.00379134, -0.00268562, 0.00056925 ], [ 0.00379134, 0.00268562, -0.00056925 ], [ -0.00379134, 0.00268562, -0.00056925 ], [ -0.00379134, -0.00268562, 0.00056925 ] ]
pbe
true
15
agm005266151-pbe-332
332
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.3666307, 7.55275306, -0.0399746 ], [ -3.3666307, 7.55275306, -0.0399746 ], [ 0, 4.14647713, 6.11213144 ] ]
agm005266151
[ [ 1.68331535, 3.77637653, -0.0199873 ], [ -1.68331535, 5.849615095, 3.03607842 ], [ 0.8243239708475238, 3.9259037666986725, 2.707915405703648 ], [ 0.8243239708475238, 13.252840918301327, 0.268201114296352 ], [ -0.8243239708475238, 15.326079483301328, 3.3242668342963517 ], [ -0.8243239708475238, 5.999142331698672, 5.763981125703648 ], [ -2.512986607720948, 10.902077602504974, 3.9852464474523006 ], [ -2.512986607720948, 10.423144212495025, 5.103001512547698 ], [ 2.512986607720948, 8.349905647495024, 2.0469357925476985 ], [ 2.512986607720948, 8.828839037504975, 0.9291807274523016 ], [ -1.874516441011407, 10.811423039488528, 1.7880326806416202 ], [ -1.8745164410114068, 6.367321645511472, 1.1880838393583795 ], [ 1.8745164410114068, 8.440560210511471, 4.244149559358379 ], [ 1.874516441011407, 12.884661604488528, 4.84409840064162 ], [ 0.19562544974473306, 4.995939237487079, 2.4900959797777675 ], [ 0.19562544974473317, 12.182805447512921, 0.48602054022223234 ], [ -0.19562544974473317, 14.25604401251292, 3.5420862602222325 ], [ -0.19562544974473306, 7.069177802487078, 5.546161699777768 ], [ -0.9205184405081681, 13.923985702073955, 5.823565034566232 ], [ -0.9205184405081681, 7.401236112926044, 3.264682925433768 ], [ 0.9205184405081681, 5.327997547926045, 0.208617205433768 ], [ 0.9205184405081681, 11.850747137073954, 2.7674993145662317 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.06362742, 0, 0 ], [ 0, 0.21663969, -0.01025563 ], [ 0, -0.01025561, 0.09520554 ] ]
-146.935148
-158.455148
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00258106, 0.00349958, -0.00291524 ], [ -0.00258106, -0.00349958, 0.00291524 ], [ 0.00258106, -0.00349958, 0.00291524 ], [ 0.00258106, 0.00349958, -0.00291524 ], [ -0.00041912, -0.00045876, -0.00364772 ], [ -0.00041912, 0.00045876, 0.00364772 ], [ 0.00041912, 0.00045876, 0.00364772 ], [ 0.00041912, -0.00045876, -0.00364772 ], [ 0.00102874, -0.00327027, 0.00112334 ], [ 0.00102874, 0.00327027, -0.00112334 ], [ -0.00102874, 0.00327027, -0.00112334 ], [ -0.00102874, -0.00327027, 0.00112334 ], [ -0.00256463, -0.00210225, 0.00085045 ], [ -0.00256463, 0.00210225, -0.00085045 ], [ 0.00256463, 0.00210225, -0.00085045 ], [ 0.00256463, -0.00210225, 0.00085045 ], [ 0.00408852, -0.00223891, 0.00067831 ], [ 0.00408852, 0.00223891, -0.00067831 ], [ -0.00408852, 0.00223891, -0.00067831 ], [ -0.00408852, -0.00223891, 0.00067831 ] ]
pbe
true
15
agm005266151-pbe-333
333
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36666926, 7.55297054, -0.04000462 ], [ -3.36666926, 7.55297054, -0.04000462 ], [ 0, 4.14657304, 6.1122831 ] ]
agm005266151
[ [ 1.68333463, 3.77648527, -0.02000231 ], [ -1.68333463, 5.84977179, 3.03613924 ], [ 0.8242775929380924, 3.925970888673441, 2.7078731409889683 ], [ 0.8242775929380928, 13.253256711326559, 0.26825916901103175 ], [ -0.8242775929380928, 15.326543231326559, 3.324400719011032 ], [ -0.8242775929380924, 5.99925740867344, 5.764014690988969 ], [ -2.5130713781432603, 10.902374421920118, 3.9852707595156955 ], [ -2.5130713781432603, 10.423426218079879, 5.103144650484305 ], [ 2.5130713781432603, 8.350139698079879, 2.0470031004843046 ], [ 2.5130713781432603, 8.829087901920118, 0.9291292095156953 ], [ -1.8745749779784253, 10.811699770586976, 1.7880901217289813 ], [ -1.8745749779784253, 6.367527829413024, 1.1880421882710186 ], [ 1.8745749779784253, 8.440814349413024, 4.244183738271019 ], [ 1.8745749779784253, 12.884986290586976, 4.8442316717289815 ], [ 0.19548891625108222, 4.995981346635631, 2.4900904441391725 ], [ 0.19548891625108222, 12.183246253364368, 0.4860418658608272 ], [ -0.19548891625108222, 14.256532773364368, 3.5421834158608276 ], [ -0.19548891625108222, 7.069267866635631, 5.5462319941391724 ], [ -0.920377146963236, 13.92445076171225, 5.8236976878651765 ], [ -0.9203771469632364, 7.401349878287746, 3.2647177221348236 ], [ 0.9203771469632364, 5.328063358287746, 0.20857617213482318 ], [ 0.920377146963236, 11.851164241712251, 2.767556137865177 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.03943884, 0, 0 ], [ 0, 0.13403982, 0.08884246 ], [ 0, 0.08884251, -0.0758023 ] ]
-146.935153
-158.455153
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00431278, 0.00349932, 0.00174287 ], [ -0.00431278, -0.00349932, -0.00174287 ], [ 0.00431278, -0.00349932, -0.00174287 ], [ 0.00431278, 0.00349932, 0.00174287 ], [ -0.00050848, -0.00377874, 0.0044269 ], [ -0.00050848, 0.00377874, -0.0044269 ], [ 0.00050848, 0.00377874, -0.0044269 ], [ 0.00050848, -0.00377874, 0.0044269 ], [ 0.00212538, -0.0033965, -0.00158495 ], [ 0.00212538, 0.0033965, 0.00158495 ], [ -0.00212538, 0.0033965, 0.00158495 ], [ -0.00212538, -0.0033965, -0.00158495 ], [ -0.00152435, -0.00247478, 0.00023793 ], [ -0.00152435, 0.00247478, -0.00023793 ], [ 0.00152435, 0.00247478, -0.00023793 ], [ 0.00152435, -0.00247478, 0.00023793 ], [ 0.00344091, -0.00231593, 0.00047977 ], [ 0.00344091, 0.00231593, -0.00047977 ], [ -0.00344091, 0.00231593, -0.00047977 ], [ -0.00344091, -0.00231593, 0.00047977 ] ]
pbe
true
15
agm005266151-pbe-334
334
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36668386, 7.55305289, -0.04001598 ], [ -3.36668386, 7.55305289, -0.04001598 ], [ 0, 4.14660935, 6.11234052 ] ]
agm005266151
[ [ 1.68334193, 3.776526445, -0.02000799 ], [ -1.68334193, 5.84983112, 3.03616227 ], [ 0.8242600247506557, 3.9259962733680593, 2.7078571614287528 ], [ 0.8242600247506555, 13.25341418163194, 0.2682811385712468 ], [ -0.8242600247506555, 15.326718856631942, 3.324451398571247 ], [ -0.8242600247506557, 5.9993009483680595, 5.764027421428754 ], [ -2.51310348651312, 10.902486776282228, 3.985279942096232 ], [ -2.51310348651312, 10.423533028717772, 5.103198877903768 ], [ 2.51310348651312, 8.350228353717773, 2.047028617903768 ], [ 2.51310348651312, 8.829182101282228, 0.9291096820962318 ], [ -1.8745971463888136, 10.811804473856164, 1.7881118367838027 ], [ -1.8745971463888131, 6.367605981143836, 1.1880264632161974 ], [ 1.8745971463888131, 8.440910656143837, 4.244196723216197 ], [ 1.8745971463888136, 12.885109148856163, 4.844282096783803 ], [ 0.19543721007918957, 4.995997255742697, 2.4900883118255996 ], [ 0.19543721007918924, 12.183413199257304, 0.4860499881744 ], [ -0.19543721007918924, 14.256717874257303, 3.5422202481744 ], [ -0.19543721007918957, 7.069301930742697, 5.5462585718256 ], [ -0.9203236690051904, 13.924626772304658, 5.823747892316579 ], [ -0.9203236690051902, 7.401393032695343, 3.2647309276834218 ], [ 0.9203236690051902, 5.328088357695343, 0.2085606676834218 ], [ 0.9203236690051904, 11.851322097304656, 2.767577632316578 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.04117255, 0, 0 ], [ 0, 0.10619672, 0.1249725 ], [ 0, 0.12497249, -0.13306751 ] ]
-146.935153
-158.455153
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00468154, 0.00370096, 0.00386044 ], [ -0.00468154, -0.00370096, -0.00386044 ], [ 0.00468154, -0.00370096, -0.00386044 ], [ 0.00468154, 0.00370096, 0.00386044 ], [ -0.00039716, -0.00499105, 0.00769238 ], [ -0.00039716, 0.00499105, -0.00769238 ], [ 0.00039716, 0.00499105, -0.00769238 ], [ 0.00039716, -0.00499105, 0.00769238 ], [ 0.00274545, -0.00350839, -0.00316131 ], [ 0.00274545, 0.00350839, 0.00316131 ], [ -0.00274545, 0.00350839, 0.00316131 ], [ -0.00274545, -0.00350839, -0.00316131 ], [ -0.00180739, -0.00279821, 0.00005304 ], [ -0.00180739, 0.00279821, -0.00005304 ], [ 0.00180739, 0.00279821, -0.00005304 ], [ 0.00180739, -0.00279821, 0.00005304 ], [ 0.003837, -0.00138021, 0.00075019 ], [ 0.003837, 0.00138021, -0.00075019 ], [ -0.003837, 0.00138021, -0.00075019 ], [ -0.003837, -0.00138021, 0.00075019 ] ]
pbe
true
15
agm005266151-pbe-335
335
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36670072, 7.5531484, -0.04 ], [ -3.36670072, 7.5531484, -0.04 ], [ 0, 4.14667495, 6.11238369 ] ]
agm005266151
[ [ 1.68335036, 3.7765742, -0.02 ], [ -1.68335036, 5.849911675, 3.036191845 ], [ 0.8242306538863273, 3.926051258266127, 2.7078584418301306 ], [ 0.8242306538863269, 13.253583016733876, 0.2683334031698692 ], [ -0.8242306538863269, 15.326920491733874, 3.324525248169869 ], [ -0.8242306538863273, 5.999388733266127, 5.76405028683013 ], [ -2.5131362384093636, 10.90261729731628, 3.9853350268084364 ], [ -2.513136238409363, 10.423691927683723, 5.103240508191563 ], [ 2.513136238409363, 8.350354452683723, 2.047048663191563 ], [ 2.5131362384093636, 8.829279822316277, 0.9291431818084365 ], [ -1.8746105068817465, 10.81192491234464, 1.788152098021925 ], [ -1.8746105068817465, 6.367709362655361, 1.1880397469780748 ], [ 1.8746105068817465, 8.441046837655362, 4.2442315919780755 ], [ 1.8746105068817465, 12.885262387344639, 4.844343943021924 ], [ 0.19538560094301272, 4.996025966800301, 2.4900946783949047 ], [ 0.19538560094301305, 12.183608308199702, 0.4860971666050952 ], [ -0.19538560094301305, 14.256945783199702, 3.542289011605095 ], [ -0.19538560094301272, 7.0693634418003, 5.546286523394905 ], [ -0.9202649839161541, 13.924840594335691, 5.823821698959569 ], [ -0.9202649839161544, 7.401468630664311, 3.2647538360404296 ], [ 0.9202649839161544, 5.328131155664311, 0.20856199104043027 ], [ 0.9202649839161541, 11.85150311933569, 2.7676298539595696 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.02818686, 0, 0 ], [ 0, 0.07708026, 0.11812156 ], [ 0, 0.11812154, -0.15839561 ] ]
-146.935156
-158.455156
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00413423, 0.00234198, 0.00485321 ], [ -0.00413423, -0.00234198, -0.00485321 ], [ 0.00413423, -0.00234198, -0.00485321 ], [ 0.00413423, 0.00234198, 0.00485321 ], [ -0.00046526, -0.00355711, 0.00457036 ], [ -0.00046526, 0.00355711, -0.00457036 ], [ 0.00046526, 0.00355711, -0.00457036 ], [ 0.00046526, -0.00355711, 0.00457036 ], [ 0.00216711, -0.00272367, -0.00284459 ], [ 0.00216711, 0.00272367, 0.00284459 ], [ -0.00216711, 0.00272367, 0.00284459 ], [ -0.00216711, -0.00272367, -0.00284459 ], [ -0.00166971, -0.0028827, -0.00022254 ], [ -0.00166971, 0.0028827, 0.00022254 ], [ 0.00166971, 0.0028827, 0.00022254 ], [ 0.00166971, -0.0028827, -0.00022254 ], [ 0.00374641, -0.00096766, 0.00070425 ], [ 0.00374641, 0.00096766, -0.00070425 ], [ -0.00374641, 0.00096766, -0.00070425 ], [ -0.00374641, -0.00096766, 0.00070425 ] ]
pbe
true
15
agm005266151-pbe-336
336
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.3667513, 7.55343492, -0.03995204 ], [ -3.3667513, 7.55343492, -0.03995204 ], [ 0, 4.14687174, 6.11251319 ] ]
agm005266151
[ [ 1.68337565, 3.77671746, -0.01997602 ], [ -1.68337565, 5.8501533299999995, 3.0362805749999997 ], [ 0.8241427076178229, 3.926216322106029, 2.7078623433081104 ], [ 0.8241427076178232, 13.25408938789397, 0.26849017169188927 ], [ -0.8241427076178232, 15.327525257893969, 3.324746766691889 ], [ -0.8241427076178229, 5.999652192106029, 5.764118938308111 ], [ -2.513234528977502, 10.903008723815997, 3.9855002354771694 ], [ -2.513234528977502, 10.424168726184003, 5.1033654695228305 ], [ 2.513234528977502, 8.350732856184003, 2.0471088745228303 ], [ 2.513234528977502, 8.829572853815996, 0.9292436404771693 ], [ -1.874650655934309, 10.812286167777536, 1.7882728428809647 ], [ -1.874650655934309, 6.368019542222463, 1.1880796721190352 ], [ 1.874650655934309, 8.441455412222464, 4.244336267119034 ], [ 1.874650655934309, 12.885722037777535, 4.844529437880965 ], [ 0.19523087137678308, 4.996112119047962, 2.4901137189415476 ], [ 0.19523087137678274, 12.184193590952038, 0.4862387960584521 ], [ -0.19523087137678274, 14.257629460952039, 3.5424953910584516 ], [ -0.19523087137678308, 7.069547989047962, 5.546370313941548 ], [ -0.9200889921804571, 13.925481807751066, 5.824043015543438 ], [ -0.920088992180457, 7.401695642248935, 3.2648226894565613 ], [ 0.920088992180457, 5.328259772248935, 0.20856609445656166 ], [ 0.9200889921804571, 11.852045937751065, 2.7677864205434384 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.00394997, 0, 0 ], [ 0, 0.01344032, 0.09925103 ], [ 0, 0.09925107, -0.22168253 ] ]
-146.93516
-158.45516
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00268256, -0.00203317, 0.0075912 ], [ -0.00268256, 0.00203317, -0.0075912 ], [ 0.00268256, 0.00203317, -0.0075912 ], [ 0.00268256, -0.00203317, 0.0075912 ], [ -0.00070695, 0.00089708, -0.00501542 ], [ -0.00070695, -0.00089708, 0.00501542 ], [ 0.00070695, -0.00089708, 0.00501542 ], [ 0.00070695, 0.00089708, -0.00501542 ], [ 0.00037463, 0.00015401, -0.00253079 ], [ 0.00037463, -0.00015401, 0.00253079 ], [ -0.00037463, -0.00015401, 0.00253079 ], [ -0.00037463, 0.00015401, -0.00253079 ], [ -0.00071364, -0.00170489, -0.00082057 ], [ -0.00071364, 0.00170489, 0.00082057 ], [ 0.00071364, 0.00170489, 0.00082057 ], [ 0.00071364, -0.00170489, -0.00082057 ], [ 0.00121916, -0.00019779, 0.00050771 ], [ 0.00121916, 0.00019779, -0.00050771 ], [ -0.00121916, 0.00019779, -0.00050771 ], [ -0.00121916, -0.00019779, 0.00050771 ] ]
pbe
true
15
agm005266151-pbe-337
337
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36676443, 7.5535103, -0.03990673 ], [ -3.36676443, 7.5535103, -0.03990673 ], [ 0, 4.14694975, 6.11250375 ] ]
agm005266151
[ [ 1.683382215, 3.77675515, -0.019953365 ], [ -1.683382215, 5.850230025, 3.03629851 ], [ 0.8241076415820161, 3.9262612099136796, 2.7078917897535253 ], [ 0.8241076415820161, 13.25423426508632, 0.2685466252464747 ], [ -0.8241076415820161, 15.32770914008632, 3.324798500246475 ], [ -0.8241076415820161, 5.99973608491368, 5.764143664753526 ], [ -2.5132628475501373, 10.903134162193576, 3.985525025679935 ], [ -2.5132628475501373, 10.424311062806424, 5.103417139320065 ], [ 2.5132628475501373, 8.350836187806424, 2.0471652643200646 ], [ 2.5132628475501373, 8.829659287193575, 0.9292731506799353 ], [ -1.8746590779203416, 10.812390889092766, 1.7883199691383618 ], [ -1.8746590779203416, 6.3681045859072345, 1.188118445861638 ], [ 1.8746590779203416, 8.441579460907235, 4.244370320861638 ], [ 1.8746590779203416, 12.885865764092767, 4.844571844138362 ], [ 0.19518897585271322, 4.9961388344970095, 2.4901119005259407 ], [ 0.19518897585271278, 12.18435664050299, 0.4863265144740597 ], [ -0.19518897585271278, 14.25783151550299, 3.5425783894740595 ], [ -0.19518897585271322, 7.069613709497009, 5.54636377552594 ], [ -0.9200394192269727, 13.925673610792208, 5.824104445321574 ], [ -0.920039419226973, 7.401771614207794, 3.2648377196784266 ], [ 0.920039419226973, 5.3282967392077945, 0.20858584467842659 ], [ 0.9200394192269727, 11.852198735792207, 2.7678525703215735 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.01463391, 0, 0 ], [ 0, -0.01381727, 0.07559685 ], [ 0, 0.07559684, -0.23923414 ] ]
-146.935163
-158.455163
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00145559, -0.00284214, 0.00533959 ], [ -0.00145559, 0.00284214, -0.00533959 ], [ 0.00145559, 0.00284214, -0.00533959 ], [ 0.00145559, -0.00284214, 0.00533959 ], [ -0.00088724, -0.00031443, -0.00222955 ], [ -0.00088724, 0.00031443, 0.00222955 ], [ 0.00088724, 0.00031443, 0.00222955 ], [ 0.00088724, -0.00031443, -0.00222955 ], [ -0.00054397, 0.00030959, -0.00102224 ], [ -0.00054397, -0.00030959, 0.00102224 ], [ 0.00054397, -0.00030959, 0.00102224 ], [ 0.00054397, 0.00030959, -0.00102224 ], [ -0.00156376, -0.00241688, -0.00094523 ], [ -0.00156376, 0.00241688, 0.00094523 ], [ 0.00156376, 0.00241688, 0.00094523 ], [ 0.00156376, -0.00241688, -0.00094523 ], [ 0.00250256, 0.00052001, 0.00116871 ], [ 0.00250256, -0.00052001, -0.00116871 ], [ -0.00250256, -0.00052001, -0.00116871 ], [ -0.00250256, 0.00052001, 0.00116871 ] ]
pbe
true
15
agm005266151-pbe-338
338
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36680383, 7.55373643, -0.03977077 ], [ -3.36680383, 7.55373643, -0.03977077 ], [ 0, 4.14718376, 6.11247542 ] ]
agm005266151
[ [ 1.683401915, 3.776868215, -0.019885385 ], [ -1.683401915, 5.850460095, 3.036352325 ], [ 0.8240025451346857, 3.9263961714844933, 2.7079802517868288 ], [ 0.824002545134686, 13.254668568515505, 0.2687159182131712 ], [ -0.824002545134686, 15.328260448515506, 3.324953628213171 ], [ -0.8240025451346857, 5.999988051484493, 5.764217961786829 ], [ -2.5133478789357846, 10.903510560740145, 3.9855993608956406 ], [ -2.5133478789357846, 10.424737939259856, 5.103572229104359 ], [ 2.5133478789357846, 8.351146059259857, 2.0473345191043593 ], [ 2.5133478789357846, 8.829918680740144, 0.9293616508956408 ], [ -1.874684315830539, 10.812704737379356, 1.7884615066088252 ], [ -1.8746843158305393, 6.368360002620644, 1.188234663391175 ], [ 1.8746843158305393, 8.441951882620643, 4.244472373391175 ], [ 1.874684315830539, 12.886296617379356, 4.8446992166088245 ], [ 0.1950632541955526, 4.996218996489061, 2.4901063911955066 ], [ 0.19506325419555282, 12.18484574351094, 0.48658977880449383 ], [ -0.19506325419555282, 14.25843762351094, 3.5428274888044937 ], [ -0.1950632541955526, 7.06981087648906, 5.546344101195507 ], [ -0.9198907006108856, 13.92624899042632, 5.824288765046625 ], [ -0.9198907006108858, 7.401999509573683, 3.264882824953375 ], [ 0.9198907006108858, 5.328407629573682, 0.2086451149533749 ], [ 0.9198907006108856, 11.85265711042632, 2.7680510550466253 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.06137998, 0, 0 ], [ 0, -0.0932297, -0.00188105 ], [ 0, -0.00188104, -0.2609774 ] ]
-146.935167
-158.455167
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00145886, -0.00405616, -0.00206186 ], [ 0.00145886, 0.00405616, 0.00206186 ], [ -0.00145886, 0.00405616, 0.00206186 ], [ -0.00145886, -0.00405616, -0.00206186 ], [ -0.00105736, -0.00349516, 0.00579579 ], [ -0.00105736, 0.00349516, -0.00579579 ], [ 0.00105736, 0.00349516, -0.00579579 ], [ 0.00105736, -0.00349516, 0.00579579 ], [ -0.0034056, 0.0029012, 0.00284741 ], [ -0.0034056, -0.0029012, -0.00284741 ], [ 0.0034056, -0.0029012, -0.00284741 ], [ 0.0034056, 0.0029012, 0.00284741 ], [ -0.00146259, -0.00235038, -0.0008503 ], [ -0.00146259, 0.00235038, 0.0008503 ], [ 0.00146259, 0.00235038, 0.0008503 ], [ 0.00146259, -0.00235038, -0.0008503 ], [ 0.00196193, 0.00153354, 0.00143131 ], [ 0.00196193, -0.00153354, -0.00143131 ], [ -0.00196193, -0.00153354, -0.00143131 ], [ -0.00196193, 0.00153354, 0.00143131 ] ]
pbe
true
15
agm005266151-pbe-339
339
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.55295388, 7.13669579, -0.00700588 ], [ -3.55295388, 7.13669579, -0.00700588 ], [ 0, 3.94936431, 6.10240129 ] ]
agm005266151
[ [ 1.77647694, 3.568347895, -0.00350294 ], [ -1.77647694, 5.5430300500000005, 3.047697705 ], [ 0.7914441394428409, 3.7443554245188646, 2.6898924055122384 ], [ 0.7914441394428411, 12.503718310481135, 0.3472964794877618 ], [ -0.7914441394428411, 14.478400465481135, 3.3984971244877618 ], [ -0.7914441394428409, 5.719037579518865, 5.741093050512239 ], [ -2.733054914582093, 10.33811754948768, 4.010801665238729 ], [ -2.7330549145820924, 9.859320495512321, 5.128788509761272 ], [ 2.7330549145820924, 7.88463834051232, 2.0775878647612713 ], [ 2.733054914582093, 8.36343539448768, 0.9596010202387284 ], [ -2.0327921846863255, 10.22604905375217, 1.8430650452026205 ], [ -2.032792184686326, 6.022024681247829, 1.1941238397973795 ], [ 2.032792184686326, 7.99670683624783, 4.24532448479738 ], [ 2.0327921846863255, 12.20073120875217, 4.894265690202621 ], [ 0.10960386623980078, 4.7685873429803545, 2.4234745710367434 ], [ 0.10960386623980067, 11.479486392019645, 0.6137143139632567 ], [ -0.10960386623980067, 13.454168547019645, 3.6649149589632573 ], [ -0.10960386623980078, 6.7432694979803545, 5.474675216036744 ], [ -1.0970388189152278, 13.064058084752132, 5.892500936169416 ], [ -1.097038818915228, 7.1333799602478685, 3.247089238830585 ], [ 1.097038818915228, 5.1586978052478685, 0.19588859383058482 ], [ 1.0970388189152278, 11.089375929752132, 2.841300291169415 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.19982506, 0, 0 ], [ 0, 2.77828883, -2.13875567 ], [ 0, -2.13875568, 2.24889418 ] ]
-146.818305
-158.338305
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.04552909, -0.00137559, -0.03670241 ], [ 0.04552909, 0.00137559, 0.03670241 ], [ -0.04552909, 0.00137559, 0.03670241 ], [ -0.04552909, -0.00137559, -0.03670241 ], [ 0.01784115, -0.08945893, 0.0945239 ], [ 0.01784115, 0.08945893, -0.0945239 ], [ -0.01784115, 0.08945893, -0.0945239 ], [ -0.01784115, -0.08945893, 0.0945239 ], [ 0.0150785, 0.01647366, -0.0358575 ], [ 0.0150785, -0.01647366, 0.0358575 ], [ -0.0150785, -0.01647366, 0.0358575 ], [ -0.0150785, 0.01647366, -0.0358575 ], [ -0.00887237, 0.06863222, 0.00378298 ], [ -0.00887237, -0.06863222, -0.00378298 ], [ 0.00887237, -0.06863222, -0.00378298 ], [ 0.00887237, 0.06863222, 0.00378298 ], [ 0.07379652, -0.02393672, -0.01266848 ], [ 0.07379652, 0.02393672, 0.01266848 ], [ -0.07379652, 0.02393672, 0.01266848 ], [ -0.07379652, -0.02393672, -0.01266848 ] ]
pbe
true
15
agm005266151-pbe-34
34
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36681499, 7.55380049, -0.03973226 ], [ -3.36681499, 7.55380049, -0.03973226 ], [ 0, 4.14725006, 6.11246739 ] ]
agm005266151
[ [ 1.683407495, 3.776900245, -0.01986613 ], [ -1.683407495, 5.850525275000001, 3.036367565 ], [ 0.8239727530366641, 3.9264344684177623, 2.7080053124407417 ], [ 0.8239727530366641, 13.25479154158224, 0.2687638625592584 ], [ -0.8239727530366641, 15.328416571582238, 3.3249975575592585 ], [ -0.8239727530366641, 6.000059498417762, 5.764239007440741 ], [ -2.513371966665468, 10.903617063983829, 3.985620358242399 ], [ -2.5133719666654675, 10.424859006016174, 5.103616206757601 ], [ 2.5133719666654675, 8.351233976016173, 2.047382511757601 ], [ 2.513371966665468, 8.82999203398383, 0.9293866632423989 ], [ -1.8746914725856547, 10.812793672395257, 1.7885016006437873 ], [ -1.8746914725856545, 6.3684323376047445, 1.1882675743562128 ], [ 1.8746914725856545, 8.442057367604745, 4.244501269356213 ], [ 1.8746914725856547, 12.886418702395257, 4.844735295643788 ], [ 0.19502764017748553, 4.996241719387182, 2.490104852821129 ], [ 0.19502764017748575, 12.18498429061282, 0.48666432217887096 ], [ -0.19502764017748575, 14.258609320612818, 3.542898017178871 ], [ -0.19502764017748553, 7.069866749387183, 5.546338547821129 ], [ -0.919848567130547, 13.926412087546382, 5.824340960614361 ], [ -0.9198485671305469, 7.402063982453619, 3.2648956043856394 ], [ 0.9198485671305469, 5.328438952453619, 0.2086619093856395 ], [ 0.919848567130547, 11.852787057546381, 2.7681072656143604 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.0589329, 0, 0 ], [ 0, -0.10267007, -0.02340614 ], [ 0, -0.02340618, -0.26091189 ] ]
-146.935167
-158.455167
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00273874, -0.00410305, -0.00436046 ], [ 0.00273874, 0.00410305, 0.00436046 ], [ -0.00273874, 0.00410305, 0.00436046 ], [ -0.00273874, -0.00410305, -0.00436046 ], [ -0.00074531, -0.0041755, 0.00812608 ], [ -0.00074531, 0.0041755, -0.00812608 ], [ 0.00074531, 0.0041755, -0.00812608 ], [ 0.00074531, -0.0041755, 0.00812608 ], [ -0.00401648, 0.00413202, 0.00364109 ], [ -0.00401648, -0.00413202, -0.00364109 ], [ 0.00401648, -0.00413202, -0.00364109 ], [ 0.00401648, 0.00413202, 0.00364109 ], [ -0.00118496, -0.00230016, -0.00089304 ], [ -0.00118496, 0.00230016, 0.00089304 ], [ 0.00118496, 0.00230016, 0.00089304 ], [ 0.00118496, -0.00230016, -0.00089304 ], [ 0.00161469, 0.00235317, 0.00121536 ], [ 0.00161469, -0.00235317, -0.00121536 ], [ -0.00161469, -0.00235317, -0.00121536 ], [ -0.00161469, 0.00235317, 0.00121536 ] ]
pbe
true
15
agm005266151-pbe-340
340
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36682194, 7.55384647, -0.0396996 ], [ -3.36682194, 7.55384647, -0.0396996 ], [ 0, 4.14730154, 6.11243167 ] ]
agm005266151
[ [ 1.68341097, 3.776923235, -0.0198498 ], [ -1.68341097, 5.850574005, 3.0363660350000004 ], [ 0.8239497077939251, 3.926454067739033, 2.7080067275617763 ], [ 0.8239497077939251, 13.254889642260967, 0.2688099074382238 ], [ -0.8239497077939251, 15.328540412260967, 3.3250257424382235 ], [ -0.8239497077939251, 6.000104837739033, 5.764222562561777 ], [ -2.5133930463320424, 10.903687051769067, 3.9856334400032285 ], [ -2.5133930463320424, 10.424958198230932, 5.103614864996771 ], [ 2.5133930463320424, 8.351307428230932, 2.0473990299967713 ], [ 2.5133930463320424, 8.830036281769067, 0.9294176050032287 ], [ -1.8747037931696384, 10.812863974271872, 1.7885333335576161 ], [ -1.874703793169638, 6.368479735728128, 1.1882833014423841 ], [ 1.874703793169638, 8.442130505728127, 4.244499136442384 ], [ 1.8747037931696384, 12.886514744271873, 4.844749168557616 ], [ 0.19499242179018772, 4.996248667268937, 2.490088861098764 ], [ 0.19499242179018772, 12.185095042731062, 0.48672777390123634 ], [ -0.19499242179018772, 14.258745812731062, 3.5429436089012367 ], [ -0.19499242179018772, 7.069899437268937, 5.546304696098764 ], [ -0.9198058555514967, 13.926540265230088, 5.824360415773965 ], [ -0.9198058555514964, 7.40210498476991, 3.2648878892260353 ], [ 0.9198058555514964, 5.32845421476991, 0.20867205422603552 ], [ 0.9198058555514967, 11.85288949523009, 2.7681445807739644 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.05500578, 0, 0 ], [ 0, -0.09601988, -0.0440392 ], [ 0, -0.04403921, -0.21594753 ] ]
-146.935168
-158.455168
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00280992, -0.00450767, -0.00509144 ], [ 0.00280992, 0.00450767, 0.00509144 ], [ -0.00280992, 0.00450767, 0.00509144 ], [ -0.00280992, -0.00450767, -0.00509144 ], [ -0.00106851, -0.00363467, 0.00674637 ], [ -0.00106851, 0.00363467, -0.00674637 ], [ 0.00106851, 0.00363467, -0.00674637 ], [ 0.00106851, -0.00363467, 0.00674637 ], [ -0.00434345, 0.00385981, 0.00400721 ], [ -0.00434345, -0.00385981, -0.00400721 ], [ 0.00434345, -0.00385981, -0.00400721 ], [ 0.00434345, 0.00385981, 0.00400721 ], [ -0.00132968, -0.00241167, -0.00064237 ], [ -0.00132968, 0.00241167, 0.00064237 ], [ 0.00132968, 0.00241167, 0.00064237 ], [ 0.00132968, -0.00241167, -0.00064237 ], [ 0.00143168, 0.0024239, 0.00159885 ], [ 0.00143168, -0.0024239, -0.00159885 ], [ -0.00143168, -0.0024239, -0.00159885 ], [ -0.00143168, 0.0024239, 0.00159885 ] ]
pbe
true
15
agm005266151-pbe-341
341
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36684278, 7.55398442, -0.03960163 ], [ -3.36684278, 7.55398442, -0.03960163 ], [ 0, 4.14745598, 6.1123245 ] ]
agm005266151
[ [ 1.68342139, 3.77699221, -0.019800815 ], [ -1.68342139, 5.8507202, 3.036361435 ], [ 0.8238806363425315, 3.926512867713781, 2.7080109640296146 ], [ 0.8238806363425315, 13.255183962286218, 0.2689480259703856 ], [ -0.8238806363425315, 15.328911952286218, 3.325110275970385 ], [ -0.8238806363425315, 6.000240857713781, 5.764173214029615 ], [ -2.5134563119285214, 10.903896756910875, 3.9856726071055077 ], [ -2.5134563119285214, 10.425256053089125, 5.103610882894492 ], [ 2.5134563119285214, 8.351528063089125, 2.047448632894492 ], [ 2.5134563119285214, 8.830168766910875, 0.9295103571055077 ], [ -1.8747408168995325, 10.813075043451851, 1.788628515543339 ], [ -1.8747408168995323, 6.36862178654815, 1.1883304744566607 ], [ 1.8747408168995323, 8.44234977654815, 4.244492724456661 ], [ 1.8747408168995325, 12.886803033451852, 4.844790765543339 ], [ 0.1948867988355092, 4.996269670455909, 2.4900409991970127 ], [ 0.1948867988355092, 12.185427159544089, 0.4869179908029869 ], [ -0.1948867988355092, 14.259155149544089, 3.543080240802987 ], [ -0.1948867988355092, 7.069997660455909, 5.546203249197013 ], [ -0.9196776496408663, 13.926924922932887, 5.824418696362827 ], [ -0.9196776496408661, 7.402227887067114, 3.264864793637173 ], [ 0.9196776496408661, 5.328499897067114, 0.20870254363717308 ], [ 0.9196776496408663, 11.853196932932885, 2.768256446362827 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.06858953, 0, 0 ], [ 0, -0.10137907, -0.10779728 ], [ 0, -0.10779729, -0.08291881 ] ]
-146.935171
-158.455171
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.0031518, -0.00428824, -0.00750252 ], [ 0.0031518, 0.00428824, 0.00750252 ], [ -0.0031518, 0.00428824, 0.00750252 ], [ -0.0031518, -0.00428824, -0.00750252 ], [ -0.00129592, -0.00133238, 0.00195922 ], [ -0.00129592, 0.00133238, -0.00195922 ], [ 0.00129592, 0.00133238, -0.00195922 ], [ 0.00129592, -0.00133238, 0.00195922 ], [ -0.00472347, 0.00405222, 0.00465785 ], [ -0.00472347, -0.00405222, -0.00465785 ], [ 0.00472347, -0.00405222, -0.00465785 ], [ 0.00472347, 0.00405222, 0.00465785 ], [ -0.00143405, -0.00225399, -0.00059206 ], [ -0.00143405, 0.00225399, 0.00059206 ], [ 0.00143405, 0.00225399, 0.00059206 ], [ 0.00143405, -0.00225399, -0.00059206 ], [ 0.00103918, 0.00295257, 0.00169856 ], [ 0.00103918, -0.00295257, -0.00169856 ], [ -0.00103918, -0.00295257, -0.00169856 ], [ -0.00103918, 0.00295257, 0.00169856 ] ]
pbe
true
15
agm005266151-pbe-342
342
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36688447, 7.55426031, -0.0394057 ], [ -3.36688447, 7.55426031, -0.0394057 ], [ 0, 4.14776488, 6.11211017 ] ]
agm005266151
[ [ 1.683442235, 3.777130155, -0.01970285 ], [ -1.683442235, 5.851012595, 3.0363522350000003 ], [ 0.8237424257940259, 3.9266305534080415, 2.708019553289558 ], [ 0.8237424257940256, 13.255772506591958, 0.2692241317104422 ], [ -0.8237424257940256, 15.329654946591958, 3.325279216710442 ], [ -0.8237424257940259, 6.000512993408042, 5.764074638289558 ], [ -2.513582886027746, 10.904316131249583, 3.9857509948172773 ], [ -2.513582886027746, 10.425851808750416, 5.103602860182723 ], [ 2.513582886027746, 8.351969368750417, 2.047547775182723 ], [ 2.513582886027746, 8.830433691249585, 0.9296959098172772 ], [ -1.8748148372029245, 10.813497098774393, 1.7888188689491031 ], [ -1.8748148372029252, 6.3689059612256065, 1.188424816050897 ], [ 1.8748148372029252, 8.442788401225606, 4.244479901050897 ], [ 1.8748148372029245, 12.887379538774393, 4.844873953949104 ], [ 0.19467554953683963, 4.996311473244273, 2.4899452142494494 ], [ 0.1946755495368393, 12.186091586755728, 0.48729847075055094 ], [ -0.1946755495368393, 14.259974026755728, 3.543353555750551 ], [ -0.19467554953683963, 7.070193913244273, 5.5460002992494495 ], [ -0.9194212355775424, 13.927694486956023, 5.824535374557181 ], [ -0.9194212355775424, 7.402473453043976, 3.2648184804428197 ], [ 0.9194212355775424, 5.328591013043976, 0.2087633954428198 ], [ 0.9194212355775424, 11.853812046956023, 2.7684802895571803 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.05983917, 0, 0 ], [ 0, -0.08923556, -0.23564856 ], [ 0, -0.23564856, 0.19426661 ] ]
-146.935172
-158.455172
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00454269, -0.00399264, -0.01234652 ], [ 0.00454269, 0.00399264, 0.01234652 ], [ -0.00454269, 0.00399264, 0.01234652 ], [ -0.00454269, -0.00399264, -0.01234652 ], [ -0.0013226, 0.00342166, -0.00740132 ], [ -0.0013226, -0.00342166, 0.00740132 ], [ 0.0013226, -0.00342166, 0.00740132 ], [ 0.0013226, 0.00342166, -0.00740132 ], [ -0.00547785, 0.00447629, 0.00643235 ], [ -0.00547785, -0.00447629, -0.00643235 ], [ 0.00547785, -0.00447629, -0.00643235 ], [ 0.00547785, 0.00447629, 0.00643235 ], [ -0.00066746, -0.00230353, -0.00034171 ], [ -0.00066746, 0.00230353, 0.00034171 ], [ 0.00066746, 0.00230353, 0.00034171 ], [ 0.00066746, -0.00230353, -0.00034171 ], [ -0.00000855, 0.00376739, 0.00185884 ], [ -0.00000855, -0.00376739, -0.00185884 ], [ 0.00000855, -0.00376739, -0.00185884 ], [ 0.00000855, 0.00376739, 0.00185884 ] ]
pbe
true
15
agm005266151-pbe-343
343
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36686612, 7.55413887, -0.03949194 ], [ -3.36686612, 7.55413887, -0.03949194 ], [ 0, 4.14762892, 6.11220451 ] ]
agm005266151
[ [ 1.68343306, 3.777069435, -0.01974597 ], [ -1.68343306, 5.850883895, 3.036356285 ], [ 0.8238032534831848, 3.92657869419407, 2.7080157604134167 ], [ 0.823803253483185, 13.25551350580593, 0.26910261458658263 ], [ -0.823803253483185, 15.32932796580593, 3.3252048695865826 ], [ -0.8238032534831848, 6.00039315419407, 5.764118015413417 ], [ -2.51352716815376, 10.904131502366015, 3.9857164553354467 ], [ -2.51352716815376, 10.425589617633985, 5.103606429664553 ], [ 2.51352716815376, 8.351775157633986, 2.0475041746645535 ], [ 2.51352716815376, 8.830317042366016, 0.9296142003354465 ], [ -1.8747822632039437, 10.813311309204897, 1.7887350557473303 ], [ -1.8747822632039433, 6.368780890795103, 1.1883833192526698 ], [ 1.8747822632039433, 8.442595350795102, 4.24448557425267 ], [ 1.8747822632039437, 12.887125769204896, 4.844837310747329 ], [ 0.19476855876675436, 4.996293060838692, 2.489987350652083 ], [ 0.19476855876675447, 12.185799139161308, 0.4871310243479168 ], [ -0.19476855876675447, 14.259613599161309, 3.543233279347917 ], [ -0.19476855876675436, 7.070107520838691, 5.546089605652083 ], [ -0.9195340985836911, 13.927355704625356, 5.824484024671727 ], [ -0.9195340985836913, 7.402365415374643, 3.264838860328273 ], [ 0.9195340985836913, 5.328550955374642, 0.2087366053282734 ], [ 0.9195340985836911, 11.853541244625356, 2.7683817696717266 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.04991191, 0, 0 ], [ 0, -0.07289511, -0.17471275 ], [ 0, -0.17471267, 0.08396983 ] ]
-146.935173
-158.455173
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00388095, -0.00392014, -0.01041617 ], [ 0.00388095, 0.00392014, 0.01041617 ], [ -0.00388095, 0.00392014, 0.01041617 ], [ -0.00388095, -0.00392014, -0.01041617 ], [ -0.00111031, 0.0016332, -0.00338612 ], [ -0.00111031, -0.0016332, 0.00338612 ], [ 0.00111031, -0.0016332, 0.00338612 ], [ 0.00111031, 0.0016332, -0.00338612 ], [ -0.0049407, 0.00441981, 0.00527061 ], [ -0.0049407, -0.00441981, -0.00527061 ], [ 0.0049407, -0.00441981, -0.00527061 ], [ 0.0049407, 0.00441981, 0.00527061 ], [ -0.00088603, -0.00228371, -0.00050183 ], [ -0.00088603, 0.00228371, 0.00050183 ], [ 0.00088603, 0.00228371, 0.00050183 ], [ 0.00088603, -0.00228371, -0.00050183 ], [ -0.00009922, 0.00335069, 0.00160858 ], [ -0.00009922, -0.00335069, -0.00160858 ], [ 0.00009922, -0.00335069, -0.00160858 ], [ 0.00009922, 0.00335069, 0.00160858 ] ]
pbe
true
15
agm005266151-pbe-344
344
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36687141, 7.55419551, -0.03948738 ], [ -3.36687141, 7.55419551, -0.03948738 ], [ 0, 4.14766335, 6.1121364 ] ]
agm005266151
[ [ 1.683435705, 3.777097755, -0.01974369 ], [ -1.683435705, 5.85092943, 3.03632451 ], [ 0.8237796666582315, 3.926565933362439, 2.707955972076144 ], [ 0.8237796666582318, 13.255656761637558, 0.2691374679238554 ], [ -0.8237796666582318, 15.32948843663756, 3.3252056679238557 ], [ -0.8237796666582315, 6.000397608362439, 5.7640241720761445 ], [ -2.513562631309078, 10.904199330945163, 3.9856641301181037 ], [ -2.5135626313090773, 10.425686714054837, 5.103565709881895 ], [ 2.5135626313090773, 8.351855039054838, 2.0474975098818957 ], [ 2.513562631309078, 8.830367655945162, 0.9295959301181038 ], [ -1.8748206620066195, 10.813406772149982, 1.7887448669616708 ], [ -1.8748206620066195, 6.368815922850018, 1.1883485730383292 ], [ 1.8748206620066195, 8.44264759785002, 4.244416773038329 ], [ 1.8748206620066195, 12.887238447149981, 4.84481306696167 ], [ 0.19470516357887702, 4.996264625850636, 2.4899331077219617 ], [ 0.19470516357887657, 12.185958069149363, 0.48716033227803834 ], [ -0.19470516357887657, 14.259789744149362, 3.543228532278038 ], [ -0.19470516357887702, 7.070096300850636, 5.546001307721962 ], [ -0.9194608998110319, 13.92750848921898, 5.824449638435141 ], [ -0.9194608998110319, 7.402377555781019, 3.2647802015648595 ], [ 0.9194608998110319, 5.328545880781019, 0.2087120015648598 ], [ 0.9194608998110319, 11.85367681421898, 2.76838143843514 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.03329492, 0, 0 ], [ 0, -0.06491233, -0.15510139 ], [ 0, -0.15510139, 0.14894053 ] ]
-146.935177
-158.455177
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00230603, -0.00236627, -0.00815757 ], [ 0.00230603, 0.00236627, 0.00815757 ], [ -0.00230603, 0.00236627, 0.00815757 ], [ -0.00230603, -0.00236627, -0.00815757 ], [ -0.00152287, 0.00141653, -0.00284425 ], [ -0.00152287, -0.00141653, 0.00284425 ], [ 0.00152287, -0.00141653, 0.00284425 ], [ 0.00152287, 0.00141653, -0.00284425 ], [ -0.00359092, 0.00269218, 0.00305249 ], [ -0.00359092, -0.00269218, -0.00305249 ], [ 0.00359092, -0.00269218, -0.00305249 ], [ 0.00359092, 0.00269218, 0.00305249 ], [ -0.00157176, -0.00225484, -0.00040734 ], [ -0.00157176, 0.00225484, 0.00040734 ], [ 0.00157176, 0.00225484, 0.00040734 ], [ 0.00157176, -0.00225484, -0.00040734 ], [ 0.0008588, 0.00387655, 0.00197848 ], [ 0.0008588, -0.00387655, -0.00197848 ], [ -0.0008588, -0.00387655, -0.00197848 ], [ -0.0008588, 0.00387655, 0.00197848 ] ]
pbe
true
15
agm005266151-pbe-345
345
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36688727, 7.55436541, -0.03947368 ], [ -3.36688727, 7.55436541, -0.03947368 ], [ 0, 4.14776665, 6.11193208 ] ]
agm005266151
[ [ 1.683443635, 3.777182705, -0.01973684 ], [ -1.683443635, 5.85106603, 3.0362291999999997 ], [ 0.8237088022611364, 3.9265276382608096, 2.707776498352685 ], [ 0.8237088022611365, 13.25608650673919, 0.26924218164731517 ], [ -0.8237088022611365, 15.32996983173919, 3.325208221647315 ], [ -0.8237088022611364, 6.00041096326081, 5.763742538352685 ], [ -2.513669047572222, 10.90440279269785, 3.9855070616585633 ], [ -2.5136690475722214, 10.425978002302148, 5.103443698341437 ], [ 2.5136690475722214, 8.35209467730215, 2.0474776583414367 ], [ 2.513669047572222, 8.830519467697851, 0.9295410216585631 ], [ -1.8749358871832131, 10.813692954879567, 1.7887743879410671 ], [ -1.8749358871832134, 6.368921190120433, 1.188244292058933 ], [ 1.8749358871832134, 8.442804515120432, 4.244210332058932 ], [ 1.8749358871832131, 12.887576279879568, 4.844740427941066 ], [ 0.19451497623647385, 4.996179117461618, 2.4897703348965416 ], [ 0.19451497623647374, 12.186435027538383, 0.4872483451034584 ], [ -0.19451497623647374, 14.260318352538384, 3.5432143851034583 ], [ -0.19451497623647385, 7.070062442461618, 5.545736374896541 ], [ -0.9192413666932069, 13.927966528351428, 5.824346514062478 ], [ -0.9192413666932071, 7.402414266648573, 3.2646042459375217 ], [ 0.9192413666932071, 5.328530941648573, 0.20863820593752164 ], [ 0.9192413666932069, 11.854083203351427, 2.7683804740624782 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.03242861, 0, 0 ], [ 0, 0.03764138, -0.08119559 ], [ 0, -0.0811956, 0.36751109 ] ]
-146.935183
-158.455183
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00236135, 0.00152231, -0.00199716 ], [ -0.00236135, -0.00152231, 0.00199716 ], [ 0.00236135, -0.00152231, 0.00199716 ], [ 0.00236135, 0.00152231, -0.00199716 ], [ -0.00157918, 0.00117899, -0.00108622 ], [ -0.00157918, -0.00117899, 0.00108622 ], [ 0.00157918, -0.00117899, 0.00108622 ], [ 0.00157918, 0.00117899, -0.00108622 ], [ 0.00195632, -0.00232205, -0.00397376 ], [ 0.00195632, 0.00232205, 0.00397376 ], [ -0.00195632, 0.00232205, 0.00397376 ], [ -0.00195632, -0.00232205, -0.00397376 ], [ -0.00159135, -0.00051297, -0.00076867 ], [ -0.00159135, 0.00051297, 0.00076867 ], [ 0.00159135, 0.00051297, 0.00076867 ], [ 0.00159135, -0.00051297, -0.00076867 ], [ -0.0000384, 0.00315422, 0.00162179 ], [ -0.0000384, -0.00315422, -0.00162179 ], [ 0.0000384, -0.00315422, -0.00162179 ], [ 0.0000384, 0.00315422, 0.00162179 ] ]
pbe
true
15
agm005266151-pbe-346
346
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36689729, 7.55441898, -0.039509 ], [ -3.36689729, 7.55441898, -0.039509 ], [ 0, 4.14776786, 6.11200498 ] ]
agm005266151
[ [ 1.683448645, 3.77720949, -0.0197545 ], [ -1.683448645, 5.85109342, 3.03624799 ], [ 0.8236791671224617, 3.9265255445619314, 2.7077658551726937 ], [ 0.8236791671224615, 13.256196345438068, 0.26921863482730646 ], [ -0.8236791671224615, 15.33008027543807, 3.3252211248273067 ], [ -0.8236791671224617, 6.000409474561931, 5.763768345172693 ], [ -2.5137074364755527, 10.904459471400159, 3.9855015827483165 ], [ -2.5137074364755527, 10.426030278599843, 5.103487887251684 ], [ 2.5137074364755527, 8.352146348599842, 2.0474853972516835 ], [ 2.5137074364755527, 8.830575541400158, 0.9294990927483162 ], [ -1.8749506250329449, 10.813753683889802, 1.788739918841221 ], [ -1.8749506250329449, 6.368968206110196, 1.1882445711587792 ], [ 1.8749506250329449, 8.442852136110197, 4.244247061158779 ], [ 1.8749506250329449, 12.887637613889801, 4.8447424088412205 ], [ 0.19446407526176857, 4.9961566067060525, 2.4897615211857547 ], [ 0.19446407526176834, 12.186565283293948, 0.4872229688142454 ], [ -0.19446407526176834, 14.260449213293949, 3.5432254588142453 ], [ -0.19446407526176857, 7.070040536706053, 5.545764011185755 ], [ -0.9191968648257105, 13.928088675409743, 5.824397282496191 ], [ -0.9191968648257102, 7.402401074590257, 3.264592187503809 ], [ 0.9191968648257102, 5.328517144590258, 0.208589697503809 ], [ 0.9191968648257105, 11.854204745409742, 2.768394792496191 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.03246077, 0, 0 ], [ 0, 0.03107931, -0.04944799 ], [ 0, -0.049448, 0.27899249 ] ]
-146.935186
-158.455186
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00197836, 0.0012357, -0.00082014 ], [ -0.00197836, -0.0012357, 0.00082014 ], [ 0.00197836, -0.0012357, 0.00082014 ], [ 0.00197836, 0.0012357, -0.00082014 ], [ -0.00139247, -0.00022601, 0.00210284 ], [ -0.00139247, 0.00022601, -0.00210284 ], [ 0.00139247, 0.00022601, -0.00210284 ], [ 0.00139247, -0.00022601, 0.00210284 ], [ 0.00191946, -0.00210651, -0.00385526 ], [ 0.00191946, 0.00210651, 0.00385526 ], [ -0.00191946, 0.00210651, 0.00385526 ], [ -0.00191946, -0.00210651, -0.00385526 ], [ -0.00208688, -0.00063841, -0.00113873 ], [ -0.00208688, 0.00063841, 0.00113873 ], [ 0.00208688, 0.00063841, 0.00113873 ], [ 0.00208688, -0.00063841, -0.00113873 ], [ 0.00116716, 0.00326546, 0.0018152 ], [ 0.00116716, -0.00326546, -0.0018152 ], [ -0.00116716, -0.00326546, -0.0018152 ], [ -0.00116716, 0.00326546, 0.0018152 ] ]
pbe
true
15
agm005266151-pbe-347
347
1
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36689729, 7.55441898, -0.039509 ], [ -3.36689729, 7.55441898, -0.039509 ], [ 0, 4.14776786, 6.11200498 ] ]
agm005266151
[ [ 1.683448645, 3.77720949, -0.0197545 ], [ -1.683448645, 5.85109342, 3.03624799 ], [ 0.8236791671224617, 3.9265255445619314, 2.7077658551726937 ], [ 0.8236791671224615, 13.256196345438068, 0.26921863482730646 ], [ -0.8236791671224615, 15.33008027543807, 3.3252211248273067 ], [ -0.8236791671224617, 6.000409474561931, 5.763768345172693 ], [ -2.5137074364755527, 10.904459471400159, 3.9855015827483165 ], [ -2.5137074364755527, 10.426030278599843, 5.103487887251684 ], [ 2.5137074364755527, 8.352146348599842, 2.0474853972516835 ], [ 2.5137074364755527, 8.830575541400158, 0.9294990927483162 ], [ -1.8749506250329449, 10.813753683889802, 1.788739918841221 ], [ -1.8749506250329449, 6.368968206110196, 1.1882445711587792 ], [ 1.8749506250329449, 8.442852136110197, 4.244247061158779 ], [ 1.8749506250329449, 12.887637613889801, 4.8447424088412205 ], [ 0.19446407526176857, 4.9961566067060525, 2.4897615211857547 ], [ 0.19446407526176834, 12.186565283293948, 0.4872229688142454 ], [ -0.19446407526176834, 14.260449213293949, 3.5432254588142453 ], [ -0.19446407526176857, 7.070040536706053, 5.545764011185755 ], [ -0.9191968648257105, 13.928088675409743, 5.824397282496191 ], [ -0.9191968648257102, 7.402401074590257, 3.264592187503809 ], [ 0.9191968648257102, 5.328517144590258, 0.208589697503809 ], [ 0.9191968648257105, 11.854204745409742, 2.768394792496191 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.10196273, 0, 0 ], [ 0, 3.50031732, 0.20362013 ], [ 0, 0.20362012, 0.8353114 ] ]
-146.961767
-158.481767
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00265993, 0.00179192, -0.00056248 ], [ -0.00265993, -0.00179192, 0.00056248 ], [ 0.00265993, -0.00179192, 0.00056248 ], [ 0.00265993, 0.00179192, -0.00056248 ], [ -0.00176314, -0.00051179, 0.00170568 ], [ -0.00176314, 0.00051179, -0.00170568 ], [ 0.00176314, 0.00051179, -0.00170568 ], [ 0.00176314, -0.00051179, 0.00170568 ], [ 0.00213724, -0.00194399, -0.00270057 ], [ 0.00213724, 0.00194399, 0.00270057 ], [ -0.00213724, 0.00194399, 0.00270057 ], [ -0.00213724, -0.00194399, -0.00270057 ], [ -0.00212304, -0.00046951, -0.00188405 ], [ -0.00212304, 0.00046951, 0.00188405 ], [ 0.00212304, 0.00046951, 0.00188405 ], [ 0.00212304, -0.00046951, -0.00188405 ], [ 0.00123614, 0.00295671, 0.00118733 ], [ 0.00123614, -0.00295671, -0.00118733 ], [ -0.00123614, -0.00295671, -0.00118733 ], [ -0.00123614, 0.00295671, 0.00118733 ] ]
pbe
true
15
agm005266151-pbe-348
348
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36704389, 7.56570803, -0.03886619 ], [ -3.36704389, 7.56570803, -0.03886619 ], [ 0, 4.1544995, 6.11454594 ] ]
agm005266151
[ [ 1.683521945, 3.782854015, -0.019433095 ], [ -1.683521945, 5.860103765, 3.037839875 ], [ 0.823586679694947, 3.9327170834235763, 2.7090460740828943 ], [ 0.8235866796949471, 13.275948726576422, 0.2704945159171058 ], [ -0.8235866796949471, 15.353198476576422, 3.3277674859171062 ], [ -0.823586679694947, 6.009966833423576, 5.766319044082895 ], [ -2.513901972447411, 10.92108143089509, 3.9879537957864875 ], [ -2.513901972447411, 10.442083879104912, 5.106132734213514 ], [ 2.513901972447411, 8.364834129104912, 2.0488597642135127 ], [ 2.513901972447411, 8.84383168089509, 0.9306808257864874 ], [ -1.8749291307758025, 10.829979880725704, 1.790187990098788 ], [ -1.8749291307758023, 6.378685929274296, 1.1893525999012122 ], [ 1.8749291307758023, 8.455935679274296, 4.246625569901212 ], [ 1.8749291307758025, 12.907229630725702, 4.847460960098788 ], [ 0.19437011705812468, 5.003818690619579, 2.490993180808156 ], [ 0.19437011705812512, 12.20484711938042, 0.4885474091918443 ], [ -0.19437011705812512, 14.282096869380418, 3.545820379191844 ], [ -0.19437011705812468, 7.081068440619579, 5.548266150808156 ], [ -0.9191772577546802, 13.949557987015773, 5.827743417805111 ], [ -0.9191772577546803, 7.413607322984227, 3.2663431121948894 ], [ 0.9191772577546803, 5.336357572984228, 0.2090701421948894 ], [ 0.9191772577546802, 11.872308237015773, 2.7704704478051108 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.40282148, 0, 0 ], [ 0, -0.50993093, 0.37943628 ], [ 0, 0.37943631, -1.73850086 ] ]
-146.962167
-158.482167
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01128754, 0.02334675, -0.02138448 ], [ -0.01128754, -0.02334675, 0.02138448 ], [ 0.01128754, -0.02334675, 0.02138448 ], [ 0.01128754, 0.02334675, -0.02138448 ], [ -0.00544423, 0.00279823, 0.0037879 ], [ -0.00544423, -0.00279823, -0.0037879 ], [ 0.00544423, -0.00279823, -0.0037879 ], [ 0.00544423, 0.00279823, 0.0037879 ], [ -0.03368465, 0.04029782, 0.0282915 ], [ -0.03368465, -0.04029782, -0.0282915 ], [ 0.03368465, -0.04029782, -0.0282915 ], [ 0.03368465, 0.04029782, 0.0282915 ], [ 0.04272327, -0.07319371, 0.01002615 ], [ 0.04272327, 0.07319371, -0.01002615 ], [ -0.04272327, 0.07319371, -0.01002615 ], [ -0.04272327, -0.07319371, 0.01002615 ], [ -0.01419111, 0.04386459, 0.00520561 ], [ -0.01419111, -0.04386459, -0.00520561 ], [ 0.01419111, -0.04386459, -0.00520561 ], [ 0.01419111, 0.04386459, 0.00520561 ] ]
pbe
true
15
agm005266151-pbe-349
349
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.55297347, 7.13667763, -0.00699137 ], [ -3.55297347, 7.13667763, -0.00699137 ], [ 0, 3.94936668, 6.10241129 ] ]
agm005266151
[ [ 1.776486735, 3.568338815, -0.003495685 ], [ -1.776486735, 5.543022155, 3.04770996 ], [ 0.7914510258569739, 3.7443514333286014, 2.6898966741156203 ], [ 0.7914510258569734, 12.5036871666714, 0.3473262308843794 ], [ -0.7914510258569734, 14.4783705066714, 3.3985318758843794 ], [ -0.7914510258569739, 5.719034773328602, 5.741102319115621 ], [ -2.7330713695467765, 10.338099361002257, 4.010832164150793 ], [ -2.733071369546777, 9.859305918997743, 5.128802030849208 ], [ 2.733071369546777, 7.884622578997743, 2.0775963858492075 ], [ 2.7330713695467765, 8.363416021002257, 0.9596265191507929 ], [ -2.03280474306725, 10.226028884439424, 1.8430843561048817 ], [ -2.03280474306725, 6.022009715560576, 1.1941385488951182 ], [ 2.03280474306725, 7.996693055560575, 4.245344193895118 ], [ 2.03280474306725, 12.200712224439425, 4.894290001104882 ], [ 0.10959544601243643, 4.768581719657089, 2.4234810791876327 ], [ 0.10959544601243643, 11.479456880342912, 0.6137418258123674 ], [ -0.10959544601243643, 13.45414022034291, 3.6649474708123675 ], [ -0.10959544601243643, 6.743265059657089, 5.474686724187633 ], [ -1.0970513340940222, 13.0640316651353, 5.892539483345814 ], [ -1.0970513340940222, 7.1333736148647, 3.247094711654186 ], [ 1.0970513340940222, 5.1586902748647, 0.1958890666541859 ], [ 1.0970513340940222, 11.0893483251353, 2.841333838345814 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.20988089, 0, 0 ], [ 0, 2.76218818, -2.14049801 ], [ 0, -2.14049816, 2.24309099 ] ]
-146.818305
-158.338305
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.0450817, -0.00131005, -0.03632104 ], [ 0.0450817, 0.00131005, 0.03632104 ], [ -0.0450817, 0.00131005, 0.03632104 ], [ -0.0450817, -0.00131005, -0.03632104 ], [ 0.0178267, -0.08878568, 0.09256959 ], [ 0.0178267, 0.08878568, -0.09256959 ], [ -0.0178267, 0.08878568, -0.09256959 ], [ -0.0178267, -0.08878568, 0.09256959 ], [ 0.01482843, 0.01653569, -0.03562858 ], [ 0.01482843, -0.01653569, 0.03562858 ], [ -0.01482843, -0.01653569, 0.03562858 ], [ -0.01482843, 0.01653569, -0.03562858 ], [ -0.00849117, 0.0678983, 0.00380144 ], [ -0.00849117, -0.0678983, -0.00380144 ], [ 0.00849117, -0.0678983, -0.00380144 ], [ 0.00849117, 0.0678983, 0.00380144 ], [ 0.07365489, -0.02412691, -0.0125089 ], [ 0.07365489, 0.02412691, 0.0125089 ], [ -0.07365489, 0.02412691, 0.0125089 ], [ -0.07365489, -0.02412691, -0.0125089 ] ]
pbe
true
15
agm005266151-pbe-35
35
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36701307, 7.56333438, -0.03900135 ], [ -3.36701307, 7.56333438, -0.03900135 ], [ 0, 4.1530841, 6.11401167 ] ]
agm005266151
[ [ 1.683506535, 3.78166719, -0.019500675 ], [ -1.683506535, 5.85820924, 3.03750516 ], [ 0.8236061444968823, 3.931415279425821, 2.7087768626985005 ], [ 0.8236061444968823, 13.271795530574177, 0.2702262723014994 ], [ -0.8236061444968823, 15.348337580574178, 3.3272321073014997 ], [ -0.8236061444968823, 6.007957329425821, 5.7657826976985005 ], [ -2.5138610491125606, 10.917586543275382, 3.987438213564055 ], [ -2.5138610491125606, 10.438708366724615, 5.105576591435945 ], [ 2.5138610491125606, 8.362166316724615, 2.0485707564359448 ], [ 2.5138610491125606, 8.841044493275383, 0.9304323785640549 ], [ -1.8749336859778591, 10.826568159975686, 1.7898835050692667 ], [ -1.8749336859778594, 6.376642650024314, 1.1891196299307334 ], [ 1.8749336859778594, 8.453184700024313, 4.246125464930733 ], [ 1.8749336859778591, 12.903110209975686, 4.846889340069267 ], [ 0.19438988678854408, 5.002207663843722, 2.490734211773334 ], [ 0.19438988678854452, 12.201003146156278, 0.488268923226666 ], [ -0.19438988678854452, 14.277545196156279, 3.5452747582266655 ], [ -0.19438988678854408, 7.078749713843722, 5.547740046773334 ], [ -0.9191813694187654, 13.945043773718227, 5.827039837157103 ], [ -0.9191813694187658, 7.411251136281773, 3.2659749678428973 ], [ 0.9191813694187658, 5.334709086281773, 0.20896913284289761 ], [ 0.9191813694187654, 11.868501723718227, 2.770034002157102 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.0932638, 0, 0 ], [ 0, 0.32167379, 0.34230135 ], [ 0, 0.34230138, -1.20853708 ] ]
-146.962199
-158.482199
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00928422, 0.0187666, -0.01705352 ], [ -0.00928422, -0.0187666, 0.01705352 ], [ 0.00928422, -0.0187666, 0.01705352 ], [ 0.00928422, 0.0187666, -0.01705352 ], [ -0.00448322, 0.00212516, 0.00329289 ], [ -0.00448322, -0.00212516, -0.00329289 ], [ 0.00448322, -0.00212516, -0.00329289 ], [ 0.00448322, 0.00212516, 0.00329289 ], [ -0.02624336, 0.03136162, 0.02243086 ], [ -0.02624336, -0.03136162, -0.02243086 ], [ 0.02624336, -0.03136162, -0.02243086 ], [ 0.02624336, 0.03136162, 0.02243086 ], [ 0.03373865, -0.05821105, 0.00755001 ], [ 0.03373865, 0.05821105, -0.00755001 ], [ -0.03373865, 0.05821105, -0.00755001 ], [ -0.03373865, -0.05821105, 0.00755001 ], [ -0.01075456, 0.03466025, 0.00432826 ], [ -0.01075456, -0.03466025, -0.00432826 ], [ 0.01075456, -0.03466025, -0.00432826 ], [ 0.01075456, 0.03466025, 0.00432826 ] ]
pbe
true
15
agm005266151-pbe-350
350
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.3667613, 7.567414, -0.03856394 ], [ -3.3667613, 7.567414, -0.03856394 ], [ 0, 4.15567982, 6.11439483 ] ]
agm005266151
[ [ 1.68338065, 3.783707, -0.01928197 ], [ -1.68338065, 5.8615469099999995, 3.037915445 ], [ 0.82341453463521, 3.933897500221136, 2.708900635318498 ], [ 0.8234145346352104, 13.278770409778865, 0.27116889968150204 ], [ -0.8234145346352104, 15.356610319778865, 3.328366314681502 ], [ -0.82341453463521, 6.011737410221135, 5.766098050318498 ], [ -2.513743775947054, 10.923720983471036, 3.9882225634016852 ], [ -2.513743775947054, 10.444626746528963, 5.106241801598315 ], [ 2.513743775947054, 8.366786836528963, 2.0490443865983146 ], [ 2.513743775947054, 8.845881073471036, 0.9310251484016853 ], [ -1.875000980420729, 10.832773197886132, 1.7907155815126785 ], [ -1.875000980420729, 6.3798947121138685, 1.1893539534873214 ], [ 1.875000980420729, 8.457734622113868, 4.246551368487322 ], [ 1.875000980420729, 12.910613107886132, 4.847912996512679 ], [ 0.19465250298273495, 5.004504790599768, 2.491120827332038 ], [ 0.19465250298273507, 12.208163119400233, 0.4889487076679626 ], [ -0.19465250298273507, 14.286003029400232, 3.5461461226679623 ], [ -0.19465250298273495, 7.0823447005997675, 5.548318242332038 ], [ -0.919191722418641, 13.953277631579567, 5.828043560837411 ], [ -0.919191722418641, 7.4150700984204345, 3.266420804162589 ], [ 0.919191722418641, 5.337230188420436, 0.20922338916258912 ], [ 0.919191722418641, 11.875437721579567, 2.7708461458374107 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.02838589, 0, 0 ], [ 0, 0.30477362, 0.38839502 ], [ 0, 0.38839508, -1.45324176 ] ]
-146.962533
-158.482533
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00153713, -0.00035614, 0.00178047 ], [ -0.00153713, 0.00035614, -0.00178047 ], [ 0.00153713, 0.00035614, -0.00178047 ], [ 0.00153713, -0.00035614, 0.00178047 ], [ -0.00550964, 0.00661789, -0.00556189 ], [ -0.00550964, -0.00661789, 0.00556189 ], [ 0.00550964, -0.00661789, 0.00556189 ], [ 0.00550964, 0.00661789, -0.00556189 ], [ -0.02252145, 0.02954959, 0.01270536 ], [ -0.02252145, -0.02954959, -0.01270536 ], [ 0.02252145, -0.02954959, -0.01270536 ], [ 0.02252145, 0.02954959, 0.01270536 ], [ 0.02241077, -0.03840294, 0.00294916 ], [ 0.02241077, 0.03840294, -0.00294916 ], [ -0.02241077, 0.03840294, -0.00294916 ], [ -0.02241077, -0.03840294, 0.00294916 ], [ -0.01281608, 0.0423942, 0.00561717 ], [ -0.01281608, -0.0423942, -0.00561717 ], [ 0.01281608, -0.0423942, -0.00561717 ], [ 0.01281608, 0.0423942, 0.00561717 ] ]
pbe
true
15
agm005266151-pbe-351
351
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36630237, 7.57485028, -0.03776664 ], [ -3.36630237, 7.57485028, -0.03776664 ], [ 0, 4.16041126, 6.11509324 ] ]
agm005266151
[ [ 1.683151185, 3.78742514, -0.01888332 ], [ -1.683151185, 5.86763077, 3.0386633 ], [ 0.8230653393211046, 3.9384225051713972, 2.709126288473639 ], [ 0.8230653393211047, 13.291483684828602, 0.27288705152636084 ], [ -0.8230653393211047, 15.371689314828602, 3.330433671526361 ], [ -0.8230653393211046, 6.018628135171397, 5.76667290847364 ], [ -2.5135299845350483, 10.934902765984003, 3.989652312263822 ], [ -2.5135299845350483, 10.455414684015997, 5.107454267736179 ], [ 2.5135299845350483, 8.375209054015997, 2.0499076477361786 ], [ 2.5135299845350483, 8.854697135984004, 0.9321056922638217 ], [ -1.8751237003286727, 10.844084123079593, 1.7922323314003958 ], [ -1.8751237003286727, 6.385822066920405, 1.1897810085996046 ], [ 1.8751237003286727, 8.466027696920406, 4.247327628599604 ], [ 1.8751237003286727, 12.924289753079595, 4.849778951400396 ], [ 0.19513111684244366, 5.00869077520691, 2.491825358925502 ], [ 0.19513111684244322, 12.22121541479309, 0.4901879810744976 ], [ -0.19513111684244322, 14.30142104479309, 3.547734601074498 ], [ -0.19513111684244366, 7.08889640520691, 5.549371978925502 ], [ -0.9192105706148643, 13.968286670184318, 5.829873184717799 ], [ -0.9192105706148644, 7.422030779815682, 3.267233395282201 ], [ 0.9192105706148644, 5.341825149815682, 0.2096867752822008 ], [ 0.9192105706148643, 11.888081040184318, 2.7723265647177993 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.86343134, 0, 0 ], [ 0, 0.41818074, 0.47386544 ], [ 0, 0.47386542, -1.83483686 ] ]
-146.962917
-158.482917
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01298124, -0.03496881, 0.03541765 ], [ 0.01298124, 0.03496881, -0.03541765 ], [ -0.01298124, 0.03496881, -0.03541765 ], [ -0.01298124, -0.03496881, 0.03541765 ], [ -0.00709338, 0.01501036, -0.02190893 ], [ -0.00709338, -0.01501036, 0.02190893 ], [ 0.00709338, -0.01501036, 0.02190893 ], [ 0.00709338, 0.01501036, -0.02190893 ], [ -0.01584882, 0.02736914, -0.00542094 ], [ -0.01584882, -0.02736914, 0.00542094 ], [ 0.01584882, -0.02736914, 0.00542094 ], [ 0.01584882, 0.02736914, -0.00542094 ], [ 0.00228075, -0.00345501, -0.00548621 ], [ 0.00228075, 0.00345501, 0.00548621 ], [ -0.00228075, 0.00345501, 0.00548621 ], [ -0.00228075, -0.00345501, -0.00548621 ], [ -0.01618312, 0.05671014, 0.00796077 ], [ -0.01618312, -0.05671014, -0.00796077 ], [ 0.01618312, -0.05671014, -0.00796077 ], [ 0.01618312, 0.05671014, 0.00796077 ] ]
pbe
true
15
agm005266151-pbe-352
352
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36538451, 7.58972284, -0.03617202 ], [ -3.36538451, 7.58972284, -0.03617202 ], [ 0, 4.16987414, 6.11649005 ] ]
agm005266151
[ [ 1.682692255, 3.79486142, -0.01808601 ], [ -1.682692255, 5.879798490000001, 3.040159015 ], [ 0.8223671088635452, 3.947473743187736, 2.709577634033752 ], [ 0.8223671088635456, 13.316909006812267, 0.2763233509662478 ], [ -0.8223671088635456, 15.401846076812266, 3.334568375966248 ], [ -0.8223671088635452, 6.032410813187736, 5.767822659033753 ], [ -2.5131023636116843, 10.957266477398745, 3.99251180406206 ], [ -2.5131023636116847, 10.476990412601257, 5.109879230937941 ], [ 2.5131023636116847, 8.392053342601255, 2.0516342059379404 ], [ 2.5131023636116843, 8.872329407398745, 0.9342667790620599 ], [ -1.8753688643510849, 10.866708018854789, 1.7952661088461752 ], [ -1.8753688643510849, 6.397674731145211, 1.1906348761538252 ], [ 1.8753688643510849, 8.482611801145211, 4.248879901153825 ], [ 1.8753688643510849, 12.95164508885479, 4.853511133846174 ], [ 0.19608809962887175, 5.017058864458349, 2.4932341109350875 ], [ 0.19608809962887142, 12.247323885541652, 0.49266687406491255 ], [ -0.19608809962887142, 14.332260955541653, 3.550911899064913 ], [ -0.19608809962887175, 7.1019959344583485, 5.551479135935088 ], [ -0.91924818275286, 13.998307681118707, 5.833532725136347 ], [ -0.9192481827528606, 7.435949208881296, 3.268858309863654 ], [ 0.9192481827528606, 5.351012138881296, 0.21061328486365372 ], [ 0.91924818275286, 11.913370611118706, 2.7752877001363463 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.54626004, 0, 0 ], [ 0, 0.55064214, 0.64602954 ], [ 0, 0.64602959, -2.63372549 ] ]
-146.962857
-158.482857
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.04196523, -0.10448069, 0.10250305 ], [ 0.04196523, 0.10448069, -0.10250305 ], [ -0.04196523, 0.10448069, -0.10250305 ], [ -0.04196523, -0.10448069, 0.10250305 ], [ -0.01043476, 0.03153517, -0.0540366 ], [ -0.01043476, -0.03153517, 0.0540366 ], [ 0.01043476, -0.03153517, 0.0540366 ], [ 0.01043476, 0.03153517, -0.0540366 ], [ -0.00282615, 0.02241615, -0.04155646 ], [ -0.00282615, -0.02241615, 0.04155646 ], [ 0.00282615, -0.02241615, 0.04155646 ], [ 0.00282615, 0.02241615, -0.04155646 ], [ -0.03865943, 0.0672329, -0.02220394 ], [ -0.03865943, -0.0672329, 0.02220394 ], [ 0.03865943, -0.0672329, 0.02220394 ], [ 0.03865943, 0.0672329, -0.02220394 ], [ -0.02358528, 0.08549208, 0.01265892 ], [ -0.02358528, -0.08549208, -0.01265892 ], [ 0.02358528, -0.08549208, -0.01265892 ], [ 0.02358528, 0.08549208, 0.01265892 ] ]
pbe
true
15
agm005266151-pbe-353
353
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36589867, 7.58139164, -0.03706528 ], [ -3.36589867, 7.58139164, -0.03706528 ], [ 0, 4.1645733, 6.1157076 ] ]
agm005266151
[ [ 1.682949335, 3.79069582, -0.01853264 ], [ -1.682949335, 5.87298247, 3.03932116 ], [ 0.8227582850145847, 3.942403874109582, 2.7093248286194997 ], [ 0.8227582850145847, 13.302666055890416, 0.2743984113805008 ], [ -0.8227582850145847, 15.384952705890417, 3.3322522113805007 ], [ -0.8227582850145847, 6.024690524109582, 5.767178628619499 ], [ -2.5133418821059847, 10.944738896727115, 3.990909974848907 ], [ -2.513341882105985, 10.464904333272885, 5.108520865151093 ], [ 2.513341882105985, 8.382617683272885, 2.050667065151093 ], [ 2.5133418821059847, 8.862452246727115, 0.9330561748489073 ], [ -1.8752314463487152, 10.854035332087996, 1.7935667944827098 ], [ -1.8752314463487152, 6.391034597912004, 1.1901564455172906 ], [ 1.8752314463487152, 8.473321247912004, 4.248010245517291 ], [ 1.8752314463487152, 12.936321982087996, 4.85142059448271 ], [ 0.19555191361168656, 5.012370090096842, 2.49244484084108 ], [ 0.19555191361168678, 12.232699839903155, 0.49127839915892 ], [ -0.19555191361168678, 14.314986489903156, 3.5491321991589198 ], [ -0.19555191361168656, 7.094656740096841, 5.55029864084108 ], [ -0.9192270950719337, 13.981491603967386, 5.831482840399725 ], [ -0.9192270950719336, 7.428151626032612, 3.267947999600276 ], [ 0.9192270950719336, 5.345864976032613, 0.2100941996002752 ], [ 0.9192270950719337, 11.899204953967388, 2.773629040399725 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.7308567, 0, 0 ], [ 0, 0.46866789, 0.55051423 ], [ 0, 0.55051419, -2.19354736 ] ]
-146.963029
-158.483029
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.02569871, -0.06534897, 0.06477885 ], [ 0.02569871, 0.06534897, -0.06477885 ], [ -0.02569871, 0.06534897, -0.06477885 ], [ -0.02569871, -0.06534897, 0.06477885 ], [ -0.00863912, 0.0222423, -0.03593005 ], [ -0.00863912, -0.0222423, 0.03593005 ], [ 0.00863912, -0.0222423, 0.03593005 ], [ 0.00863912, 0.0222423, -0.03593005 ], [ -0.01049, 0.02527683, -0.02119664 ], [ -0.01049, -0.02527683, 0.02119664 ], [ 0.01049, -0.02527683, 0.02119664 ], [ 0.01049, 0.02527683, -0.02119664 ], [ -0.01575991, 0.0271177, -0.01276756 ], [ -0.01575991, -0.0271177, 0.01276756 ], [ 0.01575991, -0.0271177, 0.01276756 ], [ 0.01575991, 0.0271177, -0.01276756 ], [ -0.01979, 0.06985505, 0.01013797 ], [ -0.01979, -0.06985505, -0.01013797 ], [ 0.01979, -0.06985505, -0.01013797 ], [ 0.01979, 0.06985505, 0.01013797 ] ]
pbe
true
15
agm005266151-pbe-354
354
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36565923, 7.58429621, -0.03664895 ], [ -3.36565923, 7.58429621, -0.03664895 ], [ 0, 4.16650448, 6.11567032 ] ]
agm005266151
[ [ 1.682829615, 3.792148105, -0.018324475 ], [ -1.682829615, 5.875400345, 3.039510685 ], [ 0.8226887170799799, 3.9440042011723313, 2.709505494868803 ], [ 0.8226887170799797, 13.30784045882767, 0.2750317651311973 ], [ -0.8226887170799797, 15.39109269882767, 3.3328669251311975 ], [ -0.8226887170799799, 6.027256441172332, 5.7673406548688035 ], [ -2.513237976372869, 10.94922882460162, 3.991266666427148 ], [ -2.51323797637287, 10.46912031539838, 5.108940913572853 ], [ 2.51323797637287, 8.38586807539838, 2.0511057535728523 ], [ 2.513237976372869, 8.86597658460162, 0.9334315064271479 ], [ -1.875272523746855, 10.858549186603504, 1.7941301619326562 ], [ -1.875272523746855, 6.393295473396496, 1.190407098067344 ], [ 1.875272523746855, 8.476547713396496, 4.248242258067345 ], [ 1.875272523746855, 12.941801426603504, 4.851965321932656 ], [ 0.1956804036733767, 5.014135041807509, 2.492598664981512 ], [ 0.1956804036733768, 12.237709618192492, 0.49193859501848797 ], [ -0.1956804036733768, 14.32096185819249, 3.5497737550184882 ], [ -0.1956804036733767, 7.09738728180751, 5.550433824981512 ], [ -0.9192763046927426, 13.987637881334688, 5.832066818766288 ], [ -0.9192763046927429, 7.43071125866531, 3.2681407612337123 ], [ 0.9192763046927429, 5.34745901866531, 0.21030560123371222 ], [ 0.9192763046927426, 11.90438564133469, 2.774231658766288 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.72015209, 0, 0 ], [ 0, 0.39172377, 0.5920476 ], [ 0, 0.59204764, -2.12309813 ] ]
-146.96328
-158.48328
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.02225769, -0.05867877, 0.06142575 ], [ 0.02225769, 0.05867877, -0.06142575 ], [ -0.02225769, 0.05867877, -0.06142575 ], [ -0.02225769, -0.05867877, 0.06142575 ], [ -0.00900131, 0.01370987, -0.01540472 ], [ -0.00900131, -0.01370987, 0.01540472 ], [ 0.00900131, -0.01370987, 0.01540472 ], [ 0.00900131, 0.01370987, -0.01540472 ], [ -0.00691083, 0.02141366, -0.02496828 ], [ -0.00691083, -0.02141366, 0.02496828 ], [ 0.00691083, -0.02141366, 0.02496828 ], [ 0.00691083, 0.02141366, -0.02496828 ], [ -0.01602939, 0.02775899, -0.01174942 ], [ -0.01602939, -0.02775899, 0.01174942 ], [ 0.01602939, -0.02775899, 0.01174942 ], [ 0.01602939, 0.02775899, -0.01174942 ], [ -0.01919127, 0.0711865, 0.01052691 ], [ -0.01919127, -0.0711865, -0.01052691 ], [ 0.01919127, -0.0711865, -0.01052691 ], [ 0.01919127, 0.0711865, 0.01052691 ] ]
pbe
true
15
agm005266151-pbe-355
355
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.3649409, 7.59300992, -0.03539997 ], [ -3.3649409, 7.59300992, -0.03539997 ], [ 0, 4.17229802, 6.11555848 ] ]
agm005266151
[ [ 1.68247045, 3.79650496, -0.017699985 ], [ -1.68247045, 5.88265397, 3.0400792549999998 ], [ 0.8224800202562609, 3.948805115426307, 2.710047408323098 ], [ 0.8224800202562608, 13.323363734573693, 0.2769318916769023 ], [ -0.8224800202562608, 15.409512744573693, 3.334711131676902 ], [ -0.8224800202562609, 6.034954125426307, 5.767826648323098 ], [ -2.512926187775077, 10.962698481528427, 3.9923366337856825 ], [ -2.512926187775077, 10.481768388471574, 5.110201146214318 ], [ 2.512926187775077, 8.395619378471574, 2.052421906214317 ], [ 2.512926187775077, 8.876549471528428, 0.9345573937856826 ], [ -1.8753957023653278, 10.872091378217029, 1.7958203352791502 ], [ -1.875395702365328, 6.400077471782974, 1.1911589647208496 ], [ 1.875395702365328, 8.486226481782975, 4.24893820472085 ], [ 1.8753957023653278, 12.958240388217028, 4.85359957527915 ], [ 0.19606571805788908, 5.019428962483305, 2.493060006534935 ], [ 0.19606571805788908, 12.252739887516697, 0.4939192934650651 ], [ -0.19606571805788908, 14.338888897516696, 3.5516985334650646 ], [ -0.19606571805788908, 7.105577972483305, 5.5508392465349345 ], [ -0.9194237993382162, 14.006078334954875, 5.833818951045512 ], [ -0.919423799338216, 7.438388535045124, 3.268718828954488 ], [ 0.919423799338216, 5.352239525045124, 0.21093958895448778 ], [ 0.9194237993382162, 11.919929324954875, 2.776039711045512 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.70354201, 0, 0 ], [ 0, 0.17440434, 0.72116275 ], [ 0, 0.7211627, -1.93286519 ] ]
-146.96391
-158.48391
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01195732, -0.03766908, 0.04997551 ], [ 0.01195732, 0.03766908, -0.04997551 ], [ -0.01195732, 0.03766908, -0.04997551 ], [ -0.01195732, -0.03766908, 0.04997551 ], [ -0.00983618, -0.01192296, 0.04597674 ], [ -0.00983618, 0.01192296, -0.04597674 ], [ 0.00983618, 0.01192296, -0.04597674 ], [ 0.00983618, -0.01192296, 0.04597674 ], [ 0.00345575, 0.01012113, -0.03538746 ], [ 0.00345575, -0.01012113, 0.03538746 ], [ -0.00345575, -0.01012113, 0.03538746 ], [ -0.00345575, 0.01012113, -0.03538746 ], [ -0.01594809, 0.02820933, -0.00852207 ], [ -0.01594809, -0.02820933, 0.00852207 ], [ 0.01594809, -0.02820933, 0.00852207 ], [ 0.01594809, 0.02820933, -0.00852207 ], [ -0.01684617, 0.07441168, 0.0117813 ], [ -0.01684617, -0.07441168, -0.0117813 ], [ 0.01684617, -0.07441168, -0.0117813 ], [ 0.01684617, 0.07441168, 0.0117813 ] ]
pbe
true
15
agm005266151-pbe-356
356
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36350425, 7.61043733, -0.03290201 ], [ -3.36350425, 7.61043733, -0.03290201 ], [ 0, 4.18388511, 6.1153348 ] ]
agm005266151
[ [ 1.681752125, 3.805218665, -0.016451005 ], [ -1.681752125, 5.89716122, 3.041216395 ], [ 0.8220626714630925, 3.958406308353415, 2.711130926991861 ], [ 0.8220626714630925, 13.354410906646583, 0.28073245300813915 ], [ -0.8220626714630925, 15.446353461646584, 3.338399853008139 ], [ -0.8220626714630925, 6.050348863353415, 5.7687983269918615 ], [ -2.51230236399267, 10.989638725526824, 3.994476893420914 ], [ -2.51230236399267, 10.507063599473177, 5.112721286579086 ], [ 2.51230236399267, 8.415121044473176, 2.0550538865790866 ], [ 2.51230236399267, 8.897696170526824, 0.9368094934209136 ], [ -1.8756416302066325, 10.899179429925162, 1.799201145423633 ], [ -1.8756416302066328, 6.4136377850748385, 1.1926622345763673 ], [ 1.8756416302066328, 8.505580340074838, 4.250329634576366 ], [ 1.8756416302066325, 12.991121984925162, 4.856868545423633 ], [ 0.196835968564675, 5.030012817113867, 2.493982151022238 ], [ 0.19683596856467522, 12.282804397886133, 0.497881228977762 ], [ -0.19683596856467522, 14.374746952886134, 3.5555486289777622 ], [ -0.196835968564675, 7.121955372113867, 5.551649551022239 ], [ -0.9197184856823801, 14.04296577397534, 5.837324010751332 ], [ -0.91971848568238, 7.453736551024662, 3.269874169248668 ], [ 0.91971848568238, 5.3617939960246614, 0.2122067692486678 ], [ 0.9197184856823801, 11.95102321897534, 2.7796566107513323 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.63328766, 0, 0 ], [ 0, -0.29211469, 0.97926467 ], [ 0, 0.97926463, -1.51796459 ] ]
-146.964597
-158.484597
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00867969, 0.00454614, 0.02734953 ], [ -0.00867969, -0.00454614, -0.02734953 ], [ 0.00867969, -0.00454614, -0.02734953 ], [ 0.00867969, 0.00454614, 0.02734953 ], [ -0.0116768, -0.06344797, 0.16900348 ], [ -0.0116768, 0.06344797, -0.16900348 ], [ 0.0116768, 0.06344797, -0.16900348 ], [ 0.0116768, -0.06344797, 0.16900348 ], [ 0.02389353, -0.01279467, -0.0566382 ], [ 0.02389353, 0.01279467, 0.0566382 ], [ -0.02389353, 0.01279467, 0.0566382 ], [ -0.02389353, -0.01279467, -0.0566382 ], [ -0.0162682, 0.02900832, -0.00198453 ], [ -0.0162682, -0.02900832, 0.00198453 ], [ 0.0162682, -0.02900832, 0.00198453 ], [ 0.0162682, 0.02900832, -0.00198453 ], [ -0.01348194, 0.08277342, 0.01459931 ], [ -0.01348194, -0.08277342, -0.01459931 ], [ 0.01348194, -0.08277342, -0.01459931 ], [ 0.01348194, 0.08277342, 0.01459931 ] ]
pbe
true
15
agm005266151-pbe-357
357
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36317552, 7.61398697, -0.03226687 ], [ -3.36317552, 7.61398697, -0.03226687 ], [ 0, 4.18634635, 6.11520636 ] ]
agm005266151
[ [ 1.68158776, 3.806993485, -0.016133435 ], [ -1.68158776, 5.90016666, 3.041469745 ], [ 0.8219529671558976, 3.9604146629417496, 2.7113998539591626 ], [ 0.8219529671558976, 13.36073245205825, 0.2816695860408374 ], [ -0.8219529671558976, 15.453905627058251, 3.3392727660408372 ], [ -0.8219529671558976, 6.05358783794175, 5.769003033959163 ], [ -2.5121701310638898, 10.99507793172119, 3.9953012837296646 ], [ -2.5121701310638898, 10.51241553327881, 5.112974516270335 ], [ 2.5121701310638898, 8.41924235827881, 2.0553713362703356 ], [ 2.5121701310638898, 8.901904756721189, 0.9376981037296643 ], [ -1.8756295348019199, 10.904706117506075, 1.799922390874368 ], [ -1.87562953480192, 6.416440997493927, 1.193147049125632 ], [ 1.87562953480192, 8.509614172493928, 4.250750229125632 ], [ 1.8756295348019199, 12.997879292506074, 4.857525570874368 ], [ 0.19696232279173276, 5.03226029968422, 2.494187225136092 ], [ 0.19696232279173254, 12.28888681531578, 0.4988822148639081 ], [ -0.19696232279173254, 14.382059990315781, 3.5564853948639086 ], [ -0.19696232279173276, 7.125433474684219, 5.551790405136092 ], [ -0.919793998539165, 14.050730667432187, 5.838151753317905 ], [ -0.9197939985391649, 7.45676279756781, 3.270124046682095 ], [ 0.9197939985391649, 5.36358962256781, 0.21252086668209502 ], [ 0.919793998539165, 11.957557492432189, 2.780548573317905 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.68187059, 0, 0 ], [ 0, -0.34222996, 0.76238571 ], [ 0, 0.76238571, -1.0203284 ] ]
-146.964977
-158.484977
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01126931, 0.01057855, 0.02292517 ], [ -0.01126931, -0.01057855, -0.02292517 ], [ 0.01126931, -0.01057855, -0.02292517 ], [ 0.01126931, 0.01057855, 0.02292517 ], [ -0.01207549, -0.0453434, 0.12685674 ], [ -0.01207549, 0.0453434, -0.12685674 ], [ 0.01207549, 0.0453434, -0.12685674 ], [ 0.01207549, -0.0453434, 0.12685674 ], [ 0.023582, -0.01442434, -0.05279633 ], [ 0.023582, 0.01442434, 0.05279633 ], [ -0.023582, 0.01442434, 0.05279633 ], [ -0.023582, -0.01442434, -0.05279633 ], [ -0.0133254, 0.02452585, 0.00034882 ], [ -0.0133254, -0.02452585, -0.00034882 ], [ 0.0133254, -0.02452585, -0.00034882 ], [ 0.0133254, 0.02452585, 0.00034882 ], [ -0.01135856, 0.08073534, 0.0146698 ], [ -0.01135856, -0.08073534, -0.0146698 ], [ 0.01135856, -0.08073534, -0.0146698 ], [ 0.01135856, 0.08073534, 0.0146698 ] ]
pbe
true
15
agm005266151-pbe-358
358
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36218933, 7.62463587, -0.03036145 ], [ -3.36218933, 7.62463587, -0.03036145 ], [ 0, 4.19373008, 6.11482106 ] ]
agm005266151
[ [ 1.681094665, 3.812317935, -0.015180725 ], [ -1.681094665, 5.909182975, 3.042229805 ], [ 0.8216239559158544, 3.966439597956927, 2.712206560417935 ], [ 0.8216239559158542, 13.379697182043072, 0.28448106958206526 ], [ -0.8216239559158542, 15.476562222043073, 3.3418915995820653 ], [ -0.8216239559158544, 6.063304637956927, 5.769617090417934 ], [ -2.511773299378584, 11.011395824953818, 3.9977742984610973 ], [ -2.511773299378584, 10.528471035046183, 5.113734391538902 ], [ 2.511773299378584, 8.431605995046183, 2.0563238615389023 ], [ 2.511773299378584, 8.914530784953817, 0.9403637684610976 ], [ -1.8755930141381578, 10.921287270041406, 1.8020863429420761 ], [ -1.8755930141381576, 6.424849509958593, 1.1946012870579241 ], [ 1.8755930141381576, 8.521714549958592, 4.252011817057924 ], [ 1.8755930141381578, 13.018152310041405, 4.859496872942075 ], [ 0.19734114746045928, 5.039001474032047, 2.494802409841451 ], [ 0.19734114746045917, 12.30713530596795, 0.5018852201585488 ], [ -0.19734114746045917, 14.404000345967951, 3.5592957501585487 ], [ -0.19734114746045928, 7.135866514032047, 5.552212939841451 ], [ -0.9200203767281154, 14.074028455121496, 5.84063531295939 ], [ -0.9200203767281157, 7.465838404878504, 3.2708733770406098 ], [ 0.9200203767281157, 5.368973364878504, 0.21346284704061008 ], [ 0.9200203767281154, 11.977163415121495, 2.78322478295939 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.78238516, 0, 0 ], [ 0, -0.42039582, 0.12340098 ], [ 0, 0.12340091, 0.50667281 ] ]
-146.965758
-158.485758
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01903314, 0.02983187, 0.00848053 ], [ -0.01903314, -0.02983187, -0.00848053 ], [ 0.01903314, -0.02983187, -0.00848053 ], [ 0.01903314, 0.02983187, 0.00848053 ], [ -0.01275306, 0.00960471, -0.00081646 ], [ -0.01275306, -0.00960471, 0.00081646 ], [ 0.01275306, -0.00960471, 0.00081646 ], [ 0.01275306, 0.00960471, -0.00081646 ], [ 0.02310264, -0.01813409, -0.04263156 ], [ 0.02310264, 0.01813409, 0.04263156 ], [ -0.02310264, 0.01813409, 0.04263156 ], [ -0.02310264, -0.01813409, -0.04263156 ], [ -0.00398681, 0.01034888, 0.00729988 ], [ -0.00398681, -0.01034888, -0.00729988 ], [ 0.00398681, -0.01034888, -0.00729988 ], [ 0.00398681, 0.01034888, 0.00729988 ], [ -0.00453154, 0.07630991, 0.01562872 ], [ -0.00453154, -0.07630991, -0.01562872 ], [ 0.00453154, -0.07630991, -0.01562872 ], [ 0.00453154, 0.07630991, 0.01562872 ] ]
pbe
true
15
agm005266151-pbe-359
359
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.5508347, 7.14008795, -0.00968088 ], [ -3.5508347, 7.14008795, -0.00968088 ], [ 0, 3.94895352, 6.1017398 ] ]
agm005266151
[ [ 1.77541735, 3.570043975, -0.00484044 ], [ -1.77541735, 5.544520735, 3.0460294599999997 ], [ 0.791089965696142, 3.7451017436894647, 2.68898262451437 ], [ 0.7910899656961421, 12.509550916310536, 0.34252551548563004 ], [ -0.7910899656961421, 14.484027676310536, 3.39339541548563 ], [ -0.791089965696142, 5.7195785036894655, 5.73985252451437 ], [ -2.731128131356394, 10.340773370887545, 4.007395393365263 ], [ -2.7311281313563938, 9.862832809112454, 5.125852546634736 ], [ 2.7311281313563938, 7.8883560491124545, 2.0749826466347363 ], [ 2.731128131356394, 8.366296610887545, 0.9565254933652635 ], [ -2.0313125136571397, 10.230137083239502, 1.8393947554479155 ], [ -2.0313125136571397, 6.024515576760497, 1.1921133845520844 ], [ 2.0313125136571397, 7.998992336760498, 4.242983284552084 ], [ 2.0313125136571397, 12.204613843239501, 4.890264655447916 ], [ 0.11041608117260704, 4.770356571068813, 2.4224642856754444 ], [ 0.1104160811726067, 11.484296088931186, 0.6090438543245555 ], [ -0.1104160811726067, 13.458772848931186, 3.6599137543245557 ], [ -0.11041608117260704, 6.744833331068813, 5.473334185675444 ], [ -1.095076427246284, 13.068393438258507, 5.887224849591838 ], [ -1.0950764272462838, 7.135212741741493, 3.246023090408162 ], [ 1.0950764272462838, 5.160735981741493, 0.19515319040816198 ], [ 1.095076427246284, 11.093916678258507, 2.8363549495918376 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.35327596, 0, 0 ], [ 0, 1.79125965, -1.56925951 ], [ 0, -1.56925953, 1.35027306 ] ]
-146.819613
-158.339613
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.04743573, -0.00296589, -0.02552634 ], [ 0.04743573, 0.00296589, 0.02552634 ], [ -0.04743573, 0.00296589, 0.02552634 ], [ -0.04743573, -0.00296589, -0.02552634 ], [ 0.0112108, -0.07479111, 0.08507961 ], [ 0.0112108, 0.07479111, -0.08507961 ], [ -0.0112108, 0.07479111, -0.08507961 ], [ -0.0112108, -0.07479111, 0.08507961 ], [ 0.01465369, 0.01709917, -0.03972041 ], [ 0.01465369, -0.01709917, 0.03972041 ], [ -0.01465369, -0.01709917, 0.03972041 ], [ -0.01465369, 0.01709917, -0.03972041 ], [ -0.00449217, 0.05408659, 0.01541747 ], [ -0.00449217, -0.05408659, -0.01541747 ], [ 0.00449217, -0.05408659, -0.01541747 ], [ 0.00449217, 0.05408659, 0.01541747 ], [ 0.06620344, -0.0105379, -0.0102344 ], [ 0.06620344, 0.0105379, 0.0102344 ], [ -0.06620344, 0.0105379, 0.0102344 ], [ -0.06620344, -0.0105379, -0.0102344 ] ]
pbe
true
15
agm005266151-pbe-36
36
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36021695, 7.64593367, -0.0265506 ], [ -3.36021695, 7.64593367, -0.0265506 ], [ 0, 4.20849754, 6.11405044 ] ]
agm005266151
[ [ 1.680108475, 3.822966835, -0.0132753 ], [ -1.680108475, 5.927215605, 3.0437499199999998 ], [ 0.820965987480813, 3.978488803733841, 2.713819347217277 ], [ 0.8209659874808128, 13.41762730626616, 0.29010467278272234 ], [ -0.8209659874808128, 15.52187607626616, 3.347129892782722 ], [ -0.820965987480813, 6.082737573733841, 5.770844567217278 ], [ -2.5109792059734803, 11.04403175912221, 4.002719659836593 ], [ -2.5109792059734803, 10.560581890877787, 5.115254800163407 ], [ 2.5109792059734803, 8.456333120877787, 2.0582295801634074 ], [ 2.5109792059734803, 8.939782989122211, 0.9456944398365928 ], [ -1.8755194387688763, 10.954454225361792, 1.8064151972377218 ], [ -1.8755194387688763, 6.441661884638208, 1.1975088227622779 ], [ 1.8755194387688763, 8.545910654638208, 4.254534042762278 ], [ 1.8755194387688763, 13.058702995361791, 4.8634404172377215 ], [ 0.19809826367246952, 5.052478613096884, 2.496031832896553 ], [ 0.19809826367246952, 12.343637496903115, 0.5078921871034467 ], [ -0.19809826367246952, 14.447886266903115, 3.5649174071034473 ], [ -0.19809826367246952, 7.156727383096884, 5.553057052896553 ], [ -0.9204725624515362, 14.12063643146827, 5.84560429584136 ], [ -0.920472562451536, 7.483977218531731, 3.27237016415864 ], [ 0.920472562451536, 5.379728448531731, 0.21534494415863997 ], [ 0.9204725624515362, 12.016387661468269, 2.7885790758413598 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.9512689, 0, 0 ], [ 0, -0.70930967, -1.18826949 ], [ 0, -1.18826955, 3.57710278 ] ]
-146.965635
-158.485635
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.03450532, 0.06808063, -0.01953997 ], [ -0.03450532, -0.06808063, 0.01953997 ], [ 0.03450532, -0.06808063, 0.01953997 ], [ 0.03450532, 0.06808063, -0.01953997 ], [ -0.01452918, 0.12087357, -0.2577383 ], [ -0.01452918, -0.12087357, 0.2577383 ], [ 0.01452918, -0.12087357, 0.2577383 ], [ 0.01452918, 0.12087357, -0.2577383 ], [ 0.02187679, -0.02623948, -0.02140969 ], [ 0.02187679, 0.02623948, 0.02140969 ], [ -0.02187679, 0.02623948, 0.02140969 ], [ -0.02187679, -0.02623948, -0.02140969 ], [ 0.01489559, -0.01816088, 0.02130829 ], [ 0.01489559, 0.01816088, -0.02130829 ], [ -0.01489559, 0.01816088, -0.02130829 ], [ -0.01489559, -0.01816088, 0.02130829 ], [ 0.00756271, 0.06839046, 0.01659263 ], [ 0.00756271, -0.06839046, -0.01659263 ], [ -0.00756271, -0.06839046, -0.01659263 ], [ -0.00756271, 0.06839046, 0.01659263 ] ]
pbe
true
15
agm005266151-pbe-360
360
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36132762, 7.63394061, -0.02869654 ], [ -3.36132762, 7.63394061, -0.02869654 ], [ 0, 4.2001818, 6.11448438 ] ]
agm005266151
[ [ 1.68066381, 3.816970305, -0.01434827 ], [ -1.68066381, 5.9170612049999995, 3.04289392 ], [ 0.8213365048069609, 3.971703539632204, 2.71291100099712 ], [ 0.8213365048069603, 13.396268580367796, 0.2869381090028802 ], [ -0.8213365048069603, 15.496359480367795, 3.3441802990028804 ], [ -0.8213365048069609, 6.071794439632204, 5.77015319099712 ], [ -2.5114262169455173, 11.025654098012334, 3.999934632251642 ], [ -2.5114262169455173, 10.542499821987665, 5.114398857748359 ], [ 2.5114262169455173, 8.442408921987665, 2.0571566677483584 ], [ 2.5114262169455173, 8.925563198012334, 0.9426924422516417 ], [ -1.875560677808878, 10.935778996160892, 1.8039778555365988 ], [ -1.875560677808878, 6.432193123839107, 1.1958712544634011 ], [ 1.875560677808878, 8.532284023839107, 4.253113444463401 ], [ 1.875560677808878, 13.035869896160891, 4.8612200455366 ], [ 0.19767174459901682, 5.044887796873456, 2.495339239926785 ], [ 0.19767174459901637, 12.323084323126542, 0.5045098700732149 ], [ -0.19767174459901637, 14.423175223126542, 3.561752060073215 ], [ -0.19767174459901682, 7.144978696873457, 5.552581429926786 ], [ -0.9202177550293393, 14.094394880075946, 5.842806768171313 ], [ -0.9202177550293392, 7.473759039924051, 3.2715267218286885 ], [ 0.9202177550293392, 5.373668139924051, 0.21428453182868842 ], [ 0.9202177550293393, 11.994303980075946, 2.7855645781713116 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.86268054, 0, 0 ], [ 0, -0.56881123, -0.44980923 ], [ 0, -0.4498093, 1.84120387 ] ]
-146.965979
-158.485979
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.0256405, 0.04628402, -0.00335592 ], [ -0.0256405, -0.04628402, 0.00335592 ], [ 0.0256405, -0.04628402, 0.00335592 ], [ 0.0256405, 0.04628402, -0.00335592 ], [ -0.01362572, 0.05778865, -0.1122521 ], [ -0.01362572, -0.05778865, 0.1122521 ], [ 0.01362572, -0.05778865, 0.1122521 ], [ 0.01362572, 0.05778865, -0.1122521 ], [ 0.02240533, -0.02191907, -0.03315191 ], [ 0.02240533, 0.02191907, 0.03315191 ], [ -0.02240533, 0.02191907, 0.03315191 ], [ -0.02240533, -0.02191907, -0.03315191 ], [ 0.00405875, -0.00186394, 0.01339301 ], [ 0.00405875, 0.00186394, -0.01339301 ], [ -0.00405875, 0.00186394, -0.01339301 ], [ -0.00405875, -0.00186394, 0.01339301 ], [ 0.00044221, 0.07314958, 0.01589117 ], [ 0.00044221, -0.07314958, -0.01589117 ], [ -0.00044221, -0.07314958, -0.01589117 ], [ -0.00044221, 0.07314958, 0.01589117 ] ]
pbe
true
15
agm005266151-pbe-361
361
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.36059347, 7.64066691, -0.02758716 ], [ -3.36059347, 7.64066691, -0.02758716 ], [ 0, 4.20477146, 6.11456178 ] ]
agm005266151
[ [ 1.680296735, 3.820333455, -0.01379358 ], [ -1.680296735, 5.922719185, 3.0434873099999997 ], [ 0.8210015878402832, 3.9756522928672124, 2.7135296607991903 ], [ 0.821001587840283, 13.408067257132789, 0.28857690920080925 ], [ -0.821001587840283, 15.510452987132787, 3.345857799200809 ], [ -0.8210015878402832, 6.078038022867212, 5.770810550799191 ], [ -2.511148961631416, 11.036134532739936, 4.001181087483032 ], [ -2.5111489616314167, 10.552356477260062, 5.115487262516967 ], [ 2.5111489616314167, 8.449970747260064, 2.0582063725169677 ], [ 2.511148961631416, 8.933748802739935, 0.9439001974830324 ], [ -1.8753951151465478, 10.946156824355052, 1.8051926626754604 ], [ -1.875395115146548, 6.437562725644949, 1.1969139073245396 ], [ 1.875395115146548, 8.53994845564495, 4.254194797324539 ], [ 1.8753951151465478, 13.048542554355052, 4.8624735526754606 ], [ 0.19792524416164237, 5.049095830838658, 2.4958691255837793 ], [ 0.19792524416164214, 12.33462371916134, 0.506237444416221 ], [ -0.19792524416164214, 14.43700944916134, 3.5635183344162207 ], [ -0.19792524416164237, 7.151481560838658, 5.553150015583779 ], [ -0.9203343792918246, 14.109350751853071, 5.844625896966585 ], [ -0.9203343792918248, 7.479140258146927, 3.2720424530334142 ], [ 0.9203343792918248, 5.376754528146928, 0.21476156303341437 ], [ 0.9203343792918246, 12.006965021853073, 2.7873450069665857 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.83870567, 0, 0 ], [ 0, -0.43888083, -0.64055672 ], [ 0, -0.64055674, 1.85830605 ] ]
-146.96639
-158.48639
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01975326, 0.04632694, -0.02431471 ], [ -0.01975326, -0.04632694, 0.02431471 ], [ 0.01975326, -0.04632694, 0.02431471 ], [ 0.01975326, 0.04632694, -0.02431471 ], [ -0.01336392, 0.04949649, -0.09556302 ], [ -0.01336392, -0.04949649, 0.09556302 ], [ 0.01336392, -0.04949649, 0.09556302 ], [ 0.01336392, 0.04949649, -0.09556302 ], [ 0.01651194, -0.01846696, -0.0200278 ], [ 0.01651194, 0.01846696, 0.0200278 ], [ -0.01651194, 0.01846696, 0.0200278 ], [ -0.01651194, -0.01846696, -0.0200278 ], [ 0.00465724, -0.0008313, 0.01464599 ], [ 0.00465724, 0.0008313, -0.01464599 ], [ -0.00465724, 0.0008313, -0.01464599 ], [ -0.00465724, -0.0008313, 0.01464599 ], [ 0.00696712, 0.06473028, 0.01546529 ], [ 0.00696712, -0.06473028, -0.01546529 ], [ -0.00696712, -0.06473028, -0.01546529 ], [ -0.00696712, 0.06473028, 0.01546529 ] ]
pbe
true
15
agm005266151-pbe-362
362
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35944907, 7.65115192, -0.02585785 ], [ -3.35944907, 7.65115192, -0.02585785 ], [ 0, 4.21192586, 6.11468243 ] ]
agm005266151
[ [ 1.679724535, 3.82557596, -0.012928925 ], [ -1.679724535, 5.931538890000001, 3.04441229 ], [ 0.8204795565512374, 3.9818079871933056, 2.714494087666971 ], [ 0.8204795565512373, 13.426458782806694, 0.29113142733302916 ], [ -0.8204795565512373, 15.532421712806695, 3.348472642333029 ], [ -0.8204795565512374, 6.087770917193305, 5.771835302666971 ], [ -2.510716647553535, 11.052472074131634, 4.003124215504986 ], [ -2.5107166475535347, 10.567720555868366, 5.117183729495014 ], [ 2.5107166475535347, 8.461757625868366, 2.059842514495014 ], [ 2.510716647553535, 8.946509144131634, 0.9457830005049862 ], [ -1.8751369685037602, 10.962334834203178, 1.8070864886820264 ], [ -1.87513696850376, 6.445931935796823, 1.1985390263179736 ], [ 1.87513696850376, 8.551894865796823, 4.255880241317975 ], [ 1.8751369685037602, 13.068297764203177, 4.864427703682026 ], [ 0.19832020464629851, 5.0556542469931465, 2.496694994665849 ], [ 0.1983202046462984, 12.352612523006854, 0.5089305203341512 ], [ -0.1983202046462984, 14.458575453006855, 3.5662717353341518 ], [ -0.19832020464629851, 7.161617176993146, 5.554036209665848 ], [ -0.9205160215560324, 14.132667846305754, 5.847462031632557 ], [ -0.9205160215560322, 7.487524783694247, 3.2728459133674432 ], [ 0.9205160215560322, 5.3815618536942464, 0.21550469836744301 ], [ 0.9205160215560324, 12.026704916305754, 2.790120816632557 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.81597978, 0, 0 ], [ 0, -0.25360656, -0.93050798 ], [ 0, -0.93050803, 1.87039482 ] ]
-146.966823
-158.486823
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01062273, 0.04662243, -0.05682008 ], [ -0.01062273, -0.04662243, 0.05682008 ], [ 0.01062273, -0.04662243, 0.05682008 ], [ 0.01062273, 0.04662243, -0.05682008 ], [ -0.01290749, 0.03633583, -0.06910222 ], [ -0.01290749, -0.03633583, 0.06910222 ], [ 0.01290749, -0.03633583, 0.06910222 ], [ 0.01290749, 0.03633583, -0.06910222 ], [ 0.00728652, -0.01333382, 0.00046665 ], [ 0.00728652, 0.01333382, -0.00046665 ], [ -0.00728652, 0.01333382, -0.00046665 ], [ -0.00728652, -0.01333382, 0.00046665 ], [ 0.00570987, 0.00031152, 0.01667213 ], [ 0.00570987, -0.00031152, -0.01667213 ], [ -0.00570987, -0.00031152, -0.01667213 ], [ -0.00570987, 0.00031152, 0.01667213 ], [ 0.01702849, 0.05185733, 0.01490059 ], [ 0.01702849, -0.05185733, -0.01490059 ], [ -0.01702849, -0.05185733, -0.01490059 ], [ -0.01702849, 0.05185733, 0.01490059 ] ]
pbe
true
15
agm005266151-pbe-363
363
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35716027, 7.67212193, -0.02239922 ], [ -3.35716027, 7.67212193, -0.02239922 ], [ 0, 4.22623465, 6.11492372 ] ]
agm005266151
[ [ 1.678580135, 3.836060965, -0.01119961 ], [ -1.678580135, 5.949178290000001, 3.0462622500000003 ], [ 0.8194358552348228, 3.9941202294589173, 2.716422762292592 ], [ 0.8194358552348229, 13.463240955541083, 0.2962406577074082 ], [ -0.8194358552348229, 15.576358280541085, 3.3537025177074082 ], [ -0.8194358552348228, 6.1072375544589175, 5.7738846222925915 ], [ -2.5098513901938864, 11.085148424309342, 4.00701061872004 ], [ -2.5098513901938864, 10.59844741069066, 5.12057652127996 ], [ 2.5098513901938864, 8.48533008569066, 2.0631146612799602 ], [ 2.5098513901938864, 8.97203109930934, 0.9495487587200397 ], [ -1.8746199982445286, 10.994694613165812, 1.8108750616180254 ], [ -1.8746199982445289, 6.462666571834189, 1.2017883583819746 ], [ 1.8746199982445289, 8.575783896834189, 4.259250218381975 ], [ 1.8746199982445286, 13.107811938165812, 4.868336921618026 ], [ 0.19910951630900564, 5.068765787726742, 2.4983458046701306 ], [ 0.1991095163090062, 12.388595397273258, 0.5143176153298699 ], [ -0.1991095163090062, 14.50171272227326, 3.5717794753298695 ], [ -0.19910951630900564, 7.181883112726742, 5.55580766467013 ], [ -0.920878596396167, 14.179316846078823, 5.853136536958558 ], [ -0.9208785963961669, 7.504278988921177, 3.274450603041442 ], [ 0.9208785963961669, 5.391161663921177, 0.21698874304144197 ], [ 0.920878596396167, 12.066199521078824, 2.795674676958558 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.71354769, 0, 0 ], [ 0, 0.14486018, -1.51439178 ], [ 0, -1.51439175, 1.94759191 ] ]
-146.967086
-158.487086
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00769721, 0.04729408, -0.12188114 ], [ 0.00769721, -0.04729408, 0.12188114 ], [ -0.00769721, -0.04729408, 0.12188114 ], [ -0.00769721, 0.04729408, -0.12188114 ], [ -0.01194964, 0.00988326, -0.01620063 ], [ -0.01194964, -0.00988326, 0.01620063 ], [ 0.01194964, -0.00988326, 0.01620063 ], [ 0.01194964, 0.00988326, -0.01620063 ], [ -0.01099949, -0.00334585, 0.04118496 ], [ -0.01099949, 0.00334585, -0.04118496 ], [ 0.01099949, 0.00334585, -0.04118496 ], [ 0.01099949, -0.00334585, 0.04118496 ], [ 0.00774772, 0.00278383, 0.02062286 ], [ 0.00774772, -0.00278383, -0.02062286 ], [ -0.00774772, -0.00278383, -0.02062286 ], [ -0.00774772, 0.00278383, 0.02062286 ], [ 0.03696596, 0.02593133, 0.01365658 ], [ 0.03696596, -0.02593133, -0.01365658 ], [ -0.03696596, -0.02593133, -0.01365658 ], [ -0.03696596, 0.02593133, 0.01365658 ] ]
pbe
true
15
agm005266151-pbe-364
364
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35612405, 7.68027611, -0.0218476 ], [ -3.35612405, 7.68027611, -0.0218476 ], [ 0, 4.23116745, 6.11538902 ] ]
agm005266151
[ [ 1.678062025, 3.840138055, -0.0109238 ], [ -1.678062025, 5.95572178, 3.04677071 ], [ 0.819054556684628, 3.998979438517421, 2.7162047704503642 ], [ 0.8190545566846277, 13.47715650648258, 0.2977945395496361 ], [ -0.8190545566846277, 15.59274023148258, 3.3554890495496363 ], [ -0.819054556684628, 6.1145631635174205, 5.773899280450364 ], [ -2.5094899733934084, 11.09750942478326, 4.0077877487981945 ], [ -2.5094899733934084, 10.60979397021674, 5.121600581201807 ], [ 2.5094899733934084, 8.49421024521674, 2.0639060712018056 ], [ 2.5094899733934084, 8.98192569978326, 0.9500932387981941 ], [ -1.8744151166181353, 11.007055109523794, 1.811765895458551 ], [ -1.8744151166181353, 6.469080835476206, 1.2022334145414495 ], [ 1.8744151166181353, 8.584664560476206, 4.25992792454145 ], [ 1.8744151166181353, 13.122638834523794, 4.86946040545855 ], [ 0.19946029194734705, 5.073635913436087, 2.498948910366096 ], [ 0.19946029194734738, 12.402500031563912, 0.515050399633904 ], [ -0.19946029194734738, 14.518083756563913, 3.572744909633904 ], [ -0.19946029194734705, 7.189219638436088, 5.556643420366096 ], [ -0.9206978276117634, 14.19701561284803, 5.854751866102664 ], [ -0.9206978276117637, 7.51028778215197, 3.274636463897337 ], [ 0.9206978276117637, 5.394704057151969, 0.216941953897337 ], [ 0.9206978276117634, 12.08143188784803, 2.797057356102663 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.42760843, 0, 0 ], [ 0, 0.62588509, -1.01308749 ], [ 0, -1.01308746, 1.17347679 ] ]
-146.967653
-158.487653
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01044182, 0.02444515, -0.08267686 ], [ 0.01044182, -0.02444515, 0.08267686 ], [ -0.01044182, -0.02444515, 0.08267686 ], [ -0.01044182, 0.02444515, -0.08267686 ], [ -0.01200767, -0.00911455, 0.02534648 ], [ -0.01200767, 0.00911455, -0.02534648 ], [ 0.01200767, 0.00911455, -0.02534648 ], [ 0.01200767, -0.00911455, 0.02534648 ], [ -0.00392365, -0.00653565, 0.02624216 ], [ -0.00392365, 0.00653565, -0.02624216 ], [ 0.00392365, 0.00653565, -0.02624216 ], [ 0.00392365, -0.00653565, 0.02624216 ], [ -0.00202024, 0.02511597, 0.01084986 ], [ -0.00202024, -0.02511597, -0.01084986 ], [ 0.00202024, -0.02511597, -0.01084986 ], [ 0.00202024, 0.02511597, 0.01084986 ], [ 0.04528968, 0.0137277, 0.01174909 ], [ 0.04528968, -0.0137277, -0.01174909 ], [ -0.04528968, -0.0137277, -0.01174909 ], [ -0.04528968, 0.0137277, 0.01174909 ] ]
pbe
true
15
agm005266151-pbe-365
365
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35499172, 7.68918666, -0.0212448 ], [ -3.35499172, 7.68918666, -0.0212448 ], [ 0, 4.23655781, 6.11589749 ] ]
agm005266151
[ [ 1.67749586, 3.84459333, -0.0106224 ], [ -1.67749586, 5.962872235, 3.047326345 ], [ 0.8186379754306513, 4.004289800225482, 2.715966524059456 ], [ 0.8186379754306512, 13.492362424774518, 0.29949262094054396 ], [ -0.8186379754306512, 15.610641329774518, 3.3574413659405438 ], [ -0.8186379754306513, 6.122568705225483, 5.773915269059456 ], [ -2.5090948729932725, 11.111017334168219, 4.008637084363249 ], [ -2.5090948729932725, 10.62219270083178, 5.12271955063675 ], [ 2.5090948729932725, 8.50391379583178, 2.0647708056367504 ], [ 2.5090948729932725, 8.992738429168218, 0.9506883393632497 ], [ -1.8741910396633064, 11.020562906623804, 1.8127394927176568 ], [ -1.8741910396633066, 6.476089318376196, 1.2027196522823436 ], [ 1.8741910396633066, 8.594368223376195, 4.260668397282343 ], [ 1.8741910396633064, 13.138841811623804, 4.870688237717657 ], [ 0.19984343679352, 5.0789569419864495, 2.499607919885455 ], [ 0.19984343679352046, 12.417695283013549, 0.5158512251145451 ], [ -0.19984343679352046, 14.53597418801355, 3.5737999701145453 ], [ -0.19984343679352, 7.19723584698645, 5.557556664885454 ], [ -0.9205002545881764, 14.216358912634632, 5.856517305833895 ], [ -0.9205002545881764, 7.5168511223653685, 3.274839329166104 ], [ 0.9205002545881764, 5.398572217365368, 0.21689058416610407 ], [ 0.9205002545881764, 12.098080007634632, 2.798568560833896 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.09534979, 0, 0 ], [ 0, 1.18754299, -0.46047333 ], [ 0, -0.46047335, 0.34698581 ] ]
-146.967955
-158.487955
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01334086, -0.00062253, -0.03958818 ], [ 0.01334086, 0.00062253, 0.03958818 ], [ -0.01334086, 0.00062253, 0.03958818 ], [ -0.01334086, -0.00062253, -0.03958818 ], [ -0.01206427, -0.0300606, 0.07096446 ], [ -0.01206427, 0.0300606, -0.07096446 ], [ 0.01206427, 0.0300606, -0.07096446 ], [ 0.01206427, -0.0300606, 0.07096446 ], [ 0.00365298, -0.00997929, 0.0090578 ], [ 0.00365298, 0.00997929, -0.0090578 ], [ -0.00365298, 0.00997929, -0.0090578 ], [ -0.00365298, -0.00997929, 0.0090578 ], [ -0.0130312, 0.04941276, 0.00058908 ], [ -0.0130312, -0.04941276, -0.00058908 ], [ 0.0130312, -0.04941276, -0.00058908 ], [ 0.0130312, 0.04941276, 0.00058908 ], [ 0.05398506, 0.0014197, 0.00993369 ], [ 0.05398506, -0.0014197, -0.00993369 ], [ -0.05398506, -0.0014197, -0.00993369 ], [ -0.05398506, 0.0014197, 0.00993369 ] ]
pbe
true
15
agm005266151-pbe-366
366
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35462775, 7.69205082, -0.02105105 ], [ -3.35462775, 7.69205082, -0.02105105 ], [ 0, 4.23829046, 6.11606092 ] ]
agm005266151
[ [ 1.677313875, 3.84602541, -0.010525525 ], [ -1.677313875, 5.96517064, 3.047504935 ], [ 0.8185040448381525, 4.005996777069778, 2.715889971890344 ], [ 0.8185040448381526, 13.497250092930221, 0.30003838810965594 ], [ -0.8185040448381526, 15.616395322930222, 3.3580688481096557 ], [ -0.8185040448381525, 6.125142007069778, 5.773920431890343 ], [ -2.508967859340488, 11.115359315230373, 4.008910022834788 ], [ -2.5089678593404874, 10.626178014769627, 5.1230792571652115 ], [ 2.5089678593404874, 8.507032784769628, 2.0650487971652116 ], [ 2.508967859340488, 8.996214085230372, 0.950879562834788 ], [ -1.87411901609859, 11.024904930435738, 1.8130524028552277 ], [ -1.8741190160985903, 6.478341939564264, 1.202875957144772 ], [ 1.8741190160985903, 8.597487169564264, 4.2609064171447715 ], [ 1.87411901609859, 13.144050160435738, 4.871082862855228 ], [ 0.1999665758364675, 5.080667097287838, 2.4998196864872697 ], [ 0.1999665758364677, 12.422579772712163, 0.5161086735127299 ], [ -0.1999665758364677, 14.541725002712164, 3.57413913351273 ], [ -0.1999665758364675, 7.199812327287837, 5.5578501464872705 ], [ -0.920436790807605, 14.222576854134115, 5.857084749259914 ], [ -0.9204367908076051, 7.518960475865887, 3.274904530740086 ], [ 0.9204367908076051, 5.399815245865887, 0.216874070740086 ], [ 0.920436790807605, 12.103431624134116, 2.7990542892599137 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.03887756, 0, 0 ], [ 0, 1.36406534, -0.28520277 ], [ 0, -0.28520277, 0.10171129 ] ]
-146.967975
-158.487975
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01428326, -0.00860163, -0.02599815 ], [ 0.01428326, 0.00860163, 0.02599815 ], [ -0.01428326, 0.00860163, 0.02599815 ], [ -0.01428326, -0.00860163, -0.02599815 ], [ -0.01210489, -0.03669767, 0.08536023 ], [ -0.01210489, 0.03669767, -0.08536023 ], [ 0.01210489, 0.03669767, -0.08536023 ], [ 0.01210489, -0.03669767, 0.08536023 ], [ 0.00623538, -0.0113686, 0.00365093 ], [ 0.00623538, 0.0113686, -0.00365093 ], [ -0.00623538, 0.0113686, -0.00365093 ], [ -0.00623538, -0.0113686, 0.00365093 ], [ -0.01667545, 0.05745322, -0.00281409 ], [ -0.01667545, -0.05745322, 0.00281409 ], [ 0.01667545, -0.05745322, 0.00281409 ], [ 0.01667545, 0.05745322, -0.00281409 ], [ 0.05651788, -0.00313226, 0.0092221 ], [ 0.05651788, 0.00313226, -0.0092221 ], [ -0.05651788, 0.00313226, -0.0092221 ], [ -0.05651788, -0.00313226, 0.0092221 ] ]
pbe
true
15
agm005266151-pbe-367
367
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35394189, 7.69846146, -0.02086826 ], [ -3.35394189, 7.69846146, -0.02086826 ], [ 0, 4.24196875, 6.11632414 ] ]
agm005266151
[ [ 1.676970945, 3.84923073, -0.01043413 ], [ -1.676970945, 5.970215104999999, 3.0477279399999997 ], [ 0.8183877135913908, 4.009598739191304, 2.7154187332152646 ], [ 0.8183877135913908, 13.508308555808696, 0.301006816784735 ], [ -0.8183877135913908, 15.629292930808695, 3.3591688867847345 ], [ -0.8183877135913908, 6.130583114191305, 5.773580803215265 ], [ -2.5088496215285643, 11.124560146679926, 4.010017728325263 ], [ -2.508849621528565, 10.635315898320073, 5.122731961674737 ], [ 2.508849621528565, 8.514331523320074, 2.0645698916747373 ], [ 2.5088496215285643, 9.003575771679927, 0.9518556583252628 ], [ -1.8739274931541714, 11.03439267743793, 1.8134332359003227 ], [ -1.8739274931541712, 6.48351461756207, 1.2029923140996772 ], [ 1.8739274931541712, 8.60449899256207, 4.261154384099677 ], [ 1.8739274931541714, 13.15537705243793, 4.871595305900323 ], [ 0.2000428454813491, 5.08504488770688, 2.5000961397615256 ], [ 0.20004284548134876, 12.432862407293118, 0.5163294102384738 ], [ -0.20004284548134876, 14.55384678229312, 3.5744914802384735 ], [ -0.2000428454813491, 7.206029262706881, 5.558258209761527 ], [ -0.9197744925360656, 14.236024110380598, 5.857964386828427 ], [ -0.9197744925360654, 7.5238519346194, 3.2747853031715732 ], [ 0.9197744925360654, 5.4028675596194, 0.2166232331715732 ], [ 0.9197744925360656, 12.115039735380599, 2.7998023168284267 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.24252325, 0, 0 ], [ 0, 0.61117752, -0.1903277 ], [ 0, -0.19032772, 0.38519841 ] ]
-146.968292
-158.488292
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00429526, -0.00444757, 0.02685394 ], [ -0.00429526, 0.00444757, -0.02685394 ], [ 0.00429526, 0.00444757, -0.02685394 ], [ 0.00429526, -0.00444757, 0.02685394 ], [ -0.01337244, 0.03233746, -0.07008644 ], [ -0.01337244, -0.03233746, 0.07008644 ], [ 0.01337244, -0.03233746, 0.07008644 ], [ 0.01337244, 0.03233746, -0.07008644 ], [ 0.00647239, -0.00708015, -0.00391371 ], [ 0.00647239, 0.00708015, 0.00391371 ], [ -0.00647239, 0.00708015, 0.00391371 ], [ -0.00647239, -0.00708015, -0.00391371 ], [ 0.00170999, 0.03032798, -0.00306008 ], [ 0.00170999, -0.03032798, 0.00306008 ], [ -0.00170999, -0.03032798, 0.00306008 ], [ -0.00170999, 0.03032798, -0.00306008 ], [ 0.05810398, -0.00371262, 0.00833693 ], [ 0.05810398, 0.00371262, -0.00833693 ], [ -0.05810398, 0.00371262, -0.00833693 ], [ -0.05810398, -0.00371262, 0.00833693 ] ]
pbe
true
15
agm005266151-pbe-368
368
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35400016, 7.69791687, -0.02088379 ], [ -3.35400016, 7.69791687, -0.02088379 ], [ 0, 4.24165628, 6.11630178 ] ]
agm005266151
[ [ 1.67700008, 3.848958435, -0.010441895 ], [ -1.67700008, 5.9697865750000005, 3.047708995 ], [ 0.8183975717210271, 4.009292777568305, 2.7154587805373938 ], [ 0.818397571721027, 13.507369102431694, 0.300924529462606 ], [ -0.818397571721027, 15.628197242431694, 3.3590754194626062 ], [ -0.8183975717210271, 6.130120917568306, 5.773609670537394 ], [ -2.5088596692432223, 11.123778569130629, 4.009923646135813 ], [ -2.5088596692432223, 10.634539590869373, 5.122761443864187 ], [ 2.5088596692432223, 8.513711450869373, 2.0646105538641875 ], [ 2.5088596692432223, 9.002950429130628, 0.9517727561358129 ], [ -1.8739437495550462, 11.033586667320181, 1.8134008779347275 ], [ -1.8739437495550464, 6.483075212679817, 1.2029824320652727 ], [ 1.8739437495550464, 8.603903352679817, 4.261133322065272 ], [ 1.8739437495550462, 13.154414807320181, 4.871551767934727 ], [ 0.20003632602257926, 5.084673022368643, 2.500072701292767 ], [ 0.20003632602257904, 12.431988857631358, 0.516310608707233 ], [ -0.20003632602257904, 14.552816997631357, 3.5744614987072327 ], [ -0.20003632602257926, 7.205501162368643, 5.558223591292767 ], [ -0.9198307538598194, 14.234881807185227, 5.8578896925514 ], [ -0.9198307538598193, 7.523436352814773, 3.274795397448599 ], [ 0.9198307538598193, 5.402608212814774, 0.21664450744859912 ], [ 0.9198307538598194, 12.114053667185226, 2.7997388025514005 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.17997464, 0, 0 ], [ 0, 0.72685027, -0.19997895 ], [ 0, -0.19997897, 0.40121338 ] ]
-146.968295
-158.488295
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00281249, -0.00465527, 0.02220178 ], [ -0.00281249, 0.00465527, -0.02220178 ], [ 0.00281249, 0.00465527, -0.02220178 ], [ 0.00281249, -0.00465527, 0.02220178 ], [ -0.01331217, 0.02653079, -0.05699683 ], [ -0.01331217, -0.02653079, 0.05699683 ], [ 0.01331217, -0.02653079, 0.05699683 ], [ 0.01331217, 0.02653079, -0.05699683 ], [ 0.00623998, -0.0071519, -0.00349928 ], [ 0.00623998, 0.0071519, 0.00349928 ], [ -0.00623998, 0.0071519, 0.00349928 ], [ -0.00623998, -0.0071519, -0.00349928 ], [ -0.00001211, 0.03239343, -0.00303622 ], [ -0.00001211, -0.03239343, 0.00303622 ], [ 0.00001211, -0.03239343, 0.00303622 ], [ 0.00001211, 0.03239343, -0.00303622 ], [ 0.05773533, -0.00337206, 0.00834148 ], [ 0.05773533, 0.00337206, -0.00834148 ], [ -0.05773533, 0.00337206, -0.00834148 ], [ -0.05773533, -0.00337206, 0.00834148 ] ]
pbe
true
15
agm005266151-pbe-369
369
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.54441838, 7.15031891, -0.01774941 ], [ -3.54441838, 7.15031891, -0.01774941 ], [ 0, 3.94771404, 6.09972534 ] ]
agm005266151
[ [ 1.77220919, 3.575159455, -0.008874705 ], [ -1.77220919, 5.549016475, 3.040987965 ], [ 0.7900061263420445, 3.747351767987376, 2.6862406869331568 ], [ 0.7900061263420448, 12.527143072012624, 0.3281231630668428 ], [ -0.7900061263420448, 14.501000092012625, 3.377985833066843 ], [ -0.7900061263420445, 5.721208787987376, 5.736103356933158 ], [ -2.725299996072907, 10.348792593120324, 3.997087681060289 ], [ -2.725299996072907, 9.873416286879676, 5.117001508939711 ], [ 2.725299996072907, 7.899559266879677, 2.067138838939711 ], [ 2.725299996072907, 8.374935573120323, 0.9472250110602891 ], [ -2.026837370884496, 10.242461694418111, 1.8283260014222034 ], [ -2.026837370884496, 6.032033145581891, 1.1860378485777965 ], [ 2.026837370884496, 8.00589016558189, 4.235900518577797 ], [ 2.026837370884496, 12.216318714418112, 4.878188671422204 ], [ 0.11287313752498163, 4.775681578017061, 2.4194130269710143 ], [ 0.11287313752498207, 11.49881326198294, 0.5949508230289854 ], [ -0.11287313752498207, 13.47267028198294, 3.6448134930289857 ], [ -0.11287313752498163, 6.749538598017061, 5.469275696971015 ], [ -1.0891587946975272, 13.08148424838428, 5.871278248641099 ], [ -1.0891587946975272, 7.14072463161572, 3.2428109413589006 ], [ 1.0891587946975272, 5.16686761161572, 0.19294827135890102 ], [ 1.0891587946975272, 11.10762722838428, 2.8214155786410995 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.72419765, 0, 0 ], [ 0, -1.10575378, 0.16793437 ], [ 0, 0.16793437, -1.29015909 ] ]
-146.822122
-158.342122
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.05409587, -0.00727873, 0.00696271 ], [ 0.05409587, 0.00727873, -0.00696271 ], [ -0.05409587, 0.00727873, -0.00696271 ], [ -0.05409587, -0.00727873, 0.00696271 ], [ -0.00775631, -0.03299276, 0.06214212 ], [ -0.00775631, 0.03299276, -0.06214212 ], [ 0.00775631, 0.03299276, -0.06214212 ], [ 0.00775631, -0.03299276, 0.06214212 ], [ 0.01475056, 0.01997188, -0.0528809 ], [ 0.01475056, -0.01997188, 0.0528809 ], [ -0.01475056, -0.01997188, 0.0528809 ], [ -0.01475056, 0.01997188, -0.0528809 ], [ 0.00781257, 0.01204784, 0.05057829 ], [ 0.00781257, -0.01204784, -0.05057829 ], [ -0.00781257, -0.01204784, -0.05057829 ], [ -0.00781257, 0.01204784, 0.05057829 ], [ 0.04435694, 0.03075012, -0.00369402 ], [ 0.04435694, -0.03075012, 0.00369402 ], [ -0.04435694, -0.03075012, 0.00369402 ], [ -0.04435694, 0.03075012, -0.00369402 ] ]
pbe
true
15
agm005266151-pbe-37
37
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35356769, 7.70195889, -0.02091353 ], [ -3.35356769, 7.70195889, -0.02091353 ], [ 0, 4.24386062, 6.11658452 ] ]
agm005266151
[ [ 1.676783845, 3.850979445, -0.010456765 ], [ -1.676783845, 5.972909755, 3.047835495 ], [ 0.8182937901197687, 4.0114539932638795, 2.715431328144945 ], [ 0.8182937901197684, 13.514394096736122, 0.3010338718550546 ], [ -0.8182937901197684, 15.636324406736122, 3.3593261318550547 ], [ -0.8182937901197687, 6.133384303263879, 5.773723588144946 ], [ -2.50888155690967, 11.129767014078139, 4.009948081034687 ], [ -2.50888155690967, 10.639941695921863, 5.123101638965313 ], [ 2.50888155690967, 8.518011385921861, 2.064809378965313 ], [ 2.50888155690967, 9.007836704078139, 0.9516558210346873 ], [ -1.8737496403859848, 11.039447624768787, 1.8134540364894756 ], [ -1.873749640385985, 6.486400465231214, 1.2030111635105243 ], [ 1.873749640385985, 8.608330775231215, 4.261303423510524 ], [ 1.8737496403859848, 13.161377934768787, 4.8717462964894755 ], [ 0.20007555870492189, 5.087686408021774, 2.500196506142416 ], [ 0.20007555870492189, 12.438161681978224, 0.5162686938575841 ], [ -0.20007555870492189, 14.560091991978226, 3.574560953857584 ], [ -0.20007555870492189, 7.209616718021774, 5.558488766142416 ], [ -0.9189024976036138, 14.24311008546509, 5.8584156182928835 ], [ -0.9189024976036136, 7.52659862453491, 3.2746341017071163 ], [ 0.9189024976036136, 5.404668314534909, 0.2163418417071162 ], [ 0.9189024976036138, 12.12117977546509, 2.8001233582928835 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.62977698, 0, 0 ], [ 0, -0.52008064, 0.15555643 ], [ 0, 0.1555564, -0.4174245 ] ]
-146.968566
-158.488566
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01638059, 0.01576582, 0.02193181 ], [ -0.01638059, -0.01576582, -0.02193181 ], [ 0.01638059, -0.01576582, -0.02193181 ], [ 0.01638059, 0.01576582, 0.02193181 ], [ -0.01395908, 0.01057947, -0.01794379 ], [ -0.01395908, -0.01057947, 0.01794379 ], [ 0.01395908, -0.01057947, 0.01794379 ], [ 0.01395908, 0.01057947, -0.01794379 ], [ 0.00075264, 0.00123865, -0.00058745 ], [ 0.00075264, -0.00123865, 0.00058745 ], [ -0.00075264, -0.00123865, 0.00058745 ], [ -0.00075264, 0.00123865, -0.00058745 ], [ 0.0188825, 0.00054152, 0.00084442 ], [ 0.0188825, -0.00054152, -0.00084442 ], [ -0.0188825, -0.00054152, -0.00084442 ], [ -0.0188825, 0.00054152, 0.00084442 ], [ 0.05430424, 0.00252691, 0.00816947 ], [ 0.05430424, -0.00252691, -0.00816947 ], [ -0.05430424, -0.00252691, -0.00816947 ], [ -0.05430424, 0.00252691, 0.00816947 ] ]
pbe
true
15
agm005266151-pbe-370
370
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35302664, 7.70701571, -0.02095075 ], [ -3.35302664, 7.70701571, -0.02095075 ], [ 0, 4.24661838, 6.11693824 ] ]
agm005266151
[ [ 1.67651332, 3.853507855, -0.010475375 ], [ -1.67651332, 5.976817045000001, 3.047993745 ], [ 0.8181639496321975, 4.014157788686673, 2.715396988429557 ], [ 0.818163949632198, 13.523182821313327, 0.30117063157044266 ], [ -0.818163949632198, 15.646492011313327, 3.359639751570443 ], [ -0.8181639496321975, 6.137466978686674, 5.773866108429557 ], [ -2.508908822372747, 11.137258998289006, 4.009978613038309 ], [ -2.508908822372747, 10.646699991710994, 5.12352724696169 ], [ 2.508908822372747, 8.523390801710994, 2.0650581269616897 ], [ 2.508908822372747, 9.013949808289006, 0.9515094930383097 ], [ -1.8735067869450415, 11.046780118420656, 1.81352054693198 ], [ -1.8735067869450412, 6.490560491579344, 1.20304707306802 ], [ 1.8735067869450412, 8.613869681579343, 4.26151619306802 ], [ 1.8735067869450415, 13.170089308420655, 4.87198966693198 ], [ 0.20012459028200646, 5.091456799370767, 2.500351453890144 ], [ 0.20012459028200658, 12.445883810629235, 0.5162161661098559 ], [ -0.20012459028200658, 14.569193000629236, 3.574685286109856 ], [ -0.20012459028200646, 7.2147659893707665, 5.558820573890144 ], [ -0.9177413300605239, 14.25340494036719, 5.85907357197859 ], [ -0.9177413300605239, 7.530554049632812, 3.2744322880214094 ], [ 0.9177413300605239, 5.4072448596328115, 0.21596316802141008 ], [ 0.9177413300605239, 12.13009575036719, 2.80060445197859 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.14978661, 0, 0 ], [ 0, -2.01341935, 0.59489527 ], [ 0, 0.59489531, -1.39184869 ] ]
-146.968662
-158.488662
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.03341125, 0.04104804, 0.02159101 ], [ -0.03341125, -0.04104804, -0.02159101 ], [ 0.03341125, -0.04104804, -0.02159101 ], [ 0.03341125, 0.04104804, 0.02159101 ], [ -0.01488178, -0.0092575, 0.03029446 ], [ -0.01488178, 0.0092575, -0.03029446 ], [ 0.01488178, 0.0092575, -0.03029446 ], [ 0.01488178, -0.0092575, 0.03029446 ], [ -0.00652137, 0.01176991, 0.00314385 ], [ -0.00652137, -0.01176991, -0.00314385 ], [ 0.00652137, -0.01176991, -0.00314385 ], [ 0.00652137, 0.01176991, 0.00314385 ], [ 0.04240866, -0.03961129, 0.00575695 ], [ 0.04240866, 0.03961129, -0.00575695 ], [ -0.04240866, 0.03961129, -0.00575695 ], [ -0.04240866, -0.03961129, 0.00575695 ], [ 0.05031003, 0.00953383, 0.00807881 ], [ 0.05031003, -0.00953383, -0.00807881 ], [ -0.05031003, -0.00953383, -0.00807881 ], [ -0.05031003, 0.00953383, 0.00807881 ] ]
pbe
true
15
agm005266151-pbe-371
371
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35257629, 7.70927557, -0.02079691 ], [ -3.35257629, 7.70927557, -0.02079691 ], [ 0, 4.24798561, 6.1169104 ] ]
agm005266151
[ [ 1.676288145, 3.854637785, -0.010398455 ], [ -1.676288145, 5.97863059, 3.0480567450000002 ], [ 0.8179144595373253, 4.015608808525351, 2.715415948826821 ], [ 0.8179144595373256, 13.526935136474648, 0.3014454311731795 ], [ -0.8179144595373256, 15.650927941474649, 3.359900631173179 ], [ -0.8179144595373253, 6.139601613525351, 5.773871148826821 ], [ -2.508877669102728, 11.14068059935675, 4.01016306996198 ], [ -2.508877669102728, 10.64984895564325, 5.12360871003802 ], [ 2.508877669102728, 8.52585615064325, 2.06515351003802 ], [ 2.508877669102728, 9.01668779435675, 0.9517078699619804 ], [ -1.8733161032961652, 11.050157904836873, 1.8137244914991606 ], [ -1.8733161032961645, 6.492386040163126, 1.2031368885008396 ], [ 1.8733161032961645, 8.616378845163126, 4.26159208850084 ], [ 1.8733161032961652, 13.174150709836873, 4.87217969149916 ], [ 0.20032223328448162, 5.09308108368073, 2.50044576766571 ], [ 0.2003222332844814, 12.449462861319269, 0.5164156123342901 ], [ -0.2003222332844814, 14.57345566631927, 3.5748708123342907 ], [ -0.20032223328448162, 7.217073888680729, 5.55890096766571 ], [ -0.9168361454880347, 14.258287829198377, 5.859490021856064 ], [ -0.9168361454880348, 7.532241725801624, 3.2742817581439363 ], [ 0.9168361454880348, 5.408248920801624, 0.21582655814393584 ], [ 0.9168361454880347, 12.134295024198376, 2.8010348218560646 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.22521867, 0, 0 ], [ 0, -2.1671653, 0.58015526 ], [ 0, 0.58015524, -1.57123378 ] ]
-146.968873
-158.488873
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02870691, 0.03351672, 0.02291287 ], [ -0.02870691, -0.03351672, -0.02291287 ], [ 0.02870691, -0.03351672, -0.02291287 ], [ 0.02870691, 0.03351672, 0.02291287 ], [ -0.0154131, -0.00816304, 0.028414 ], [ -0.0154131, 0.00816304, -0.028414 ], [ 0.0154131, 0.00816304, -0.028414 ], [ 0.0154131, -0.00816304, 0.028414 ], [ -0.01031054, 0.01594723, 0.00608652 ], [ -0.01031054, -0.01594723, -0.00608652 ], [ 0.01031054, -0.01594723, -0.00608652 ], [ 0.01031054, 0.01594723, 0.00608652 ], [ 0.04098194, -0.03880387, 0.0047845 ], [ 0.04098194, 0.03880387, -0.0047845 ], [ -0.04098194, 0.03880387, -0.0047845 ], [ -0.04098194, -0.03880387, 0.0047845 ], [ 0.04756758, 0.01210216, 0.00838106 ], [ 0.04756758, -0.01210216, -0.00838106 ], [ -0.04756758, -0.01210216, -0.00838106 ], [ -0.04756758, 0.01210216, 0.00838106 ] ]
pbe
true
15
agm005266151-pbe-372
372
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.35122524, 7.71605516, -0.02033539 ], [ -3.35122524, 7.71605516, -0.02033539 ], [ 0, 4.25208728, 6.11682689 ] ]
agm005266151
[ [ 1.67561262, 3.85802758, -0.010167695 ], [ -1.67561262, 5.98407122, 3.04824575 ], [ 0.8171661472590925, 4.019962366089214, 2.7154729513686857 ], [ 0.8171661472590923, 13.538191593910787, 0.30226971363131405 ], [ -0.8171661472590923, 15.664235233910787, 3.360683158631314 ], [ -0.8171661472590925, 6.146006006089214, 5.7738863963686855 ], [ -2.508783816858304, 11.150945442928624, 4.010716457940941 ], [ -2.508783816858304, 10.659295797071376, 5.123853097059059 ], [ 2.508783816858304, 8.533252157071377, 2.0654396520590597 ], [ 2.508783816858304, 9.024901802928623, 0.9523030129409401 ], [ -1.8727439205889262, 11.06029159885028, 1.8143364101101684 ], [ -1.8727439205889262, 6.4978623611497195, 1.2034062548898317 ], [ 1.8727439205889262, 8.623906001149718, 4.2618196998898314 ], [ 1.8727439205889262, 13.186335238850281, 4.872749855110168 ], [ 0.2009149009093909, 5.097954347749562, 2.500728784906561 ], [ 0.20091490090939113, 12.460199612250438, 0.5170138800934392 ], [ -0.20091490090939113, 14.586243252250439, 3.5754273250934387 ], [ -0.2009149009093909, 7.223997987749561, 5.559142229906561 ], [ -0.9141214835573566, 14.272938462481221, 5.860739591060912 ], [ -0.9141214835573567, 7.537302777518777, 3.273829963939088 ], [ 0.9141214835573567, 5.411259137518777, 0.21541651893908798 ], [ 0.9141214835573566, 12.146894822481222, 2.8023261460609117 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.43527581, 0, 0 ], [ 0, -2.55903951, 0.54075986 ], [ 0, 0.54075989, -2.07074699 ] ]
-146.969421
-158.489421
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.0140287, 0.01073962, 0.02627381 ], [ -0.0140287, -0.01073962, -0.02627381 ], [ 0.0140287, -0.01073962, -0.02627381 ], [ 0.0140287, 0.01073962, 0.02627381 ], [ -0.01621943, -0.00508503, 0.02259755 ], [ -0.01621943, 0.00508503, -0.02259755 ], [ 0.01621943, 0.00508503, -0.02259755 ], [ 0.01621943, -0.00508503, 0.02259755 ], [ -0.02120889, 0.02866653, 0.01439889 ], [ -0.02120889, -0.02866653, -0.01439889 ], [ 0.02120889, -0.02866653, -0.01439889 ], [ 0.02120889, 0.02866653, 0.01439889 ], [ 0.03715301, -0.03654978, 0.00189778 ], [ 0.03715301, 0.03654978, -0.00189778 ], [ -0.03715301, 0.03654978, -0.00189778 ], [ -0.03715301, -0.03654978, 0.00189778 ], [ 0.04076733, 0.0194649, 0.00939769 ], [ 0.04076733, -0.0194649, -0.00939769 ], [ -0.04076733, -0.0194649, -0.00939769 ], [ -0.04076733, 0.0194649, 0.00939769 ] ]
pbe
true
15
agm005266151-pbe-373
373
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.34852314, 7.72961433, -0.01941235 ], [ -3.34852314, 7.72961433, -0.01941235 ], [ 0, 4.26029062, 6.11665988 ] ]
agm005266151
[ [ 1.67426157, 3.864807165, -0.009706175 ], [ -1.67426157, 5.994952475, 3.0486237650000003 ], [ 0.8156701336809714, 4.028671733511957, 2.715587027142107 ], [ 0.8156701336809715, 13.560702236488044, 0.30391821285789294 ], [ -0.8156701336809715, 15.690847546488044, 3.362248152857893 ], [ -0.8156701336809714, 6.158817043511958, 5.773916967142108 ], [ -2.5085945969460672, 11.171475880324106, 4.011823164070244 ], [ -2.5085945969460672, 10.678188709675895, 5.124341955929756 ], [ 2.5085945969460672, 8.548043399675896, 2.066012015929756 ], [ 2.5085945969460672, 9.041330570324106, 0.953493224070244 ], [ -1.871599314049298, 11.080560100011573, 1.815560282689623 ], [ -1.8715993140492984, 6.50881386998843, 1.2039449573103769 ], [ 1.8715993140492984, 8.63895917998843, 4.262274897310378 ], [ 1.871599314049298, 13.210705410011572, 4.8738902226896235 ], [ 0.2020991095577579, 5.107701660045725, 2.50129487368337 ], [ 0.20209910955775756, 12.481672309954275, 0.5182103663166306 ], [ -0.20209910955775756, 14.611817619954277, 3.576540306316631 ], [ -0.2020991095577579, 7.237846970045725, 5.559624813683369 ], [ -0.9086959907970138, 14.302245912351237, 5.863238893807664 ], [ -0.908695990797014, 7.547418677648766, 3.2729262261923364 ], [ 0.908695990797014, 5.417273367648765, 0.21459628619233614 ], [ 0.9086959907970138, 12.172100602351238, 2.8049089538076637 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.84912787, 0, 0 ], [ 0, -3.34901925, 0.4691855 ], [ 0, 0.4691855, -3.06029666 ] ]
-146.970153
-158.490153
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01477459, -0.03455694, 0.03353099 ], [ 0.01477459, 0.03455694, -0.03353099 ], [ -0.01477459, 0.03455694, -0.03353099 ], [ -0.01477459, -0.03455694, 0.03353099 ], [ -0.01798772, 0.00098356, 0.01142276 ], [ -0.01798772, -0.00098356, -0.01142276 ], [ 0.01798772, -0.00098356, -0.01142276 ], [ 0.01798772, 0.00098356, 0.01142276 ], [ -0.04284499, 0.05391059, 0.03020643 ], [ -0.04284499, -0.05391059, -0.03020643 ], [ 0.04284499, -0.05391059, -0.03020643 ], [ 0.04284499, 0.05391059, 0.03020643 ], [ 0.02912347, -0.0316907, -0.00367933 ], [ 0.02912347, 0.0316907, 0.00367933 ], [ -0.02912347, 0.0316907, 0.00367933 ], [ -0.02912347, -0.0316907, -0.00367933 ], [ 0.02666701, 0.03454687, 0.01156894 ], [ 0.02666701, -0.03454687, -0.01156894 ], [ -0.02666701, -0.03454687, -0.01156894 ], [ -0.02666701, 0.03454687, 0.01156894 ] ]
pbe
true
15
agm005266151-pbe-374
374
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.34689881, 7.73224212, -0.01870315 ], [ -3.34689881, 7.73224212, -0.01870315 ], [ 0, 4.26229594, 6.11496976 ] ]
agm005266151
[ [ 1.673449405, 3.86612106, -0.009351575 ], [ -1.673449405, 5.99726903, 3.048133305 ], [ 0.8151171907206162, 4.030414292655712, 2.7153684500484925 ], [ 0.8151171907206161, 13.565217917344288, 0.3047101299515078 ], [ -0.8151171907206161, 15.696365887344289, 3.362195009951508 ], [ -0.8151171907206162, 6.161562262655712, 5.772853330048492 ], [ -2.5082665759922285, 11.17582296727682, 4.011682278778088 ], [ -2.508266575992228, 10.68210518272318, 5.123366061221912 ], [ 2.508266575992228, 8.55095721272318, 2.0658811812219127 ], [ 2.5082665759922285, 9.04467499727682, 0.9541973987780878 ], [ -1.8712929943751133, 11.085309661873724, 1.8163169708203393 ], [ -1.8712929943751129, 6.510322548126276, 1.203761609179661 ], [ 1.8712929943751129, 8.641470518126276, 4.261246489179661 ], [ 1.8712929943751133, 13.216457631873723, 4.873801850820339 ], [ 0.20282578294367914, 5.109508601227786, 2.5009581779490646 ], [ 0.20282578294367903, 12.486123608772216, 0.519120402050935 ], [ -0.20282578294367903, 14.617271578772217, 3.576605282050935 ], [ -0.20282578294367914, 7.240656571227785, 5.558443057949065 ], [ -0.9061913276889313, 14.309349871297446, 5.863218639414865 ], [ -0.9061913276889311, 7.5485782787025535, 3.271829700585136 ], [ 0.9061913276889311, 5.417430308702554, 0.214344820585136 ], [ 0.9061913276889313, 12.178201901297447, 2.805733759414864 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.22282492, 0, 0 ], [ 0, -1.59594584, 0.25861337 ], [ 0, 0.25861336, -1.15253149 ] ]
-146.971138
-158.491138
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01341459, -0.0356359, 0.04108428 ], [ 0.01341459, 0.0356359, -0.04108428 ], [ -0.01341459, 0.0356359, -0.04108428 ], [ -0.01341459, -0.0356359, 0.04108428 ], [ -0.01717583, 0.01297799, -0.01754151 ], [ -0.01717583, -0.01297799, 0.01754151 ], [ 0.01717583, -0.01297799, 0.01754151 ], [ 0.01717583, 0.01297799, -0.01754151 ], [ -0.01841179, 0.02515416, 0.00744711 ], [ -0.01841179, -0.02515416, -0.00744711 ], [ 0.01841179, -0.02515416, -0.00744711 ], [ 0.01841179, 0.02515416, 0.00744711 ], [ 0.0041962, 0.00347476, -0.00573466 ], [ 0.0041962, -0.00347476, 0.00573466 ], [ -0.0041962, -0.00347476, 0.00573466 ], [ -0.0041962, 0.00347476, -0.00573466 ], [ 0.02678481, 0.02595963, 0.01162372 ], [ 0.02678481, -0.02595963, -0.01162372 ], [ -0.02678481, -0.02595963, -0.01162372 ], [ -0.02678481, 0.02595963, 0.01162372 ] ]
pbe
true
15
agm005266151-pbe-375
375
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.34466853, 7.73585019, -0.01772937 ], [ -3.34466853, 7.73585019, -0.01772937 ], [ 0, 4.26504933, 6.11264914 ] ]
agm005266151
[ [ 1.672334265, 3.867925095, -0.008864685 ], [ -1.672334265, 6.00044976, 3.0474598850000003 ], [ 0.8143580875633938, 4.032806986413497, 2.7150680995740224 ], [ 0.8143580875633933, 13.571418058586504, 0.3057977304259776 ], [ -0.8143580875633933, 15.703942723586504, 3.362122300425978 ], [ -0.8143580875633938, 6.165331651413497, 5.7713926695740225 ], [ -2.507815439431182, 11.181791857371913, 4.0114886574433894 ], [ -2.507815439431182, 10.687482517628087, 5.122026312556612 ], [ 2.507815439431182, 8.554957852628087, 2.0657017425566115 ], [ 2.507815439431182, 9.049267192371913, 0.9551640874433885 ], [ -1.870871915926423, 11.091831474996024, 1.8173558160075423 ], [ -1.8708719159264229, 6.512393570003976, 1.203510013992458 ], [ 1.8708719159264229, 8.644918235003976, 4.259834583992458 ], [ 1.870871915926423, 13.224356139996024, 4.873680386007543 ], [ 0.203822762350788, 5.111989329809535, 2.500495830860759 ], [ 0.203822762350788, 12.492235715190464, 0.5203699991392412 ], [ -0.203822762350788, 14.624760380190464, 3.5766945691392413 ], [ -0.203822762350788, 7.244513994809536, 5.556820400860759 ], [ -0.9027541649093371, 14.319105006284897, 5.863190686213802 ], [ -0.9027541649093374, 7.550169368715103, 3.2703242837861985 ], [ 0.9027541649093374, 5.417644703715103, 0.2139997137861987 ], [ 0.9027541649093371, 12.186580341284897, 2.806866116213801 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.35614638, 0, 0 ], [ 0, 0.84762322, -0.03190907 ], [ 0, -0.03190912, 1.50933735 ] ]
-146.97178
-158.49178
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01148252, -0.03718557, 0.05140078 ], [ 0.01148252, 0.03718557, -0.05140078 ], [ -0.01148252, 0.03718557, -0.05140078 ], [ -0.01148252, -0.03718557, 0.05140078 ], [ -0.01610973, 0.0295911, -0.05772053 ], [ -0.01610973, -0.0295911, 0.05772053 ], [ 0.01610973, -0.0295911, 0.05772053 ], [ 0.01610973, 0.0295911, -0.05772053 ], [ 0.01512211, -0.01490598, -0.02451616 ], [ 0.01512211, 0.01490598, 0.02451616 ], [ -0.01512211, 0.01490598, 0.02451616 ], [ -0.01512211, -0.01490598, -0.02451616 ], [ -0.03029999, 0.05232639, -0.00837404 ], [ -0.03029999, -0.05232639, 0.00837404 ], [ 0.03029999, -0.05232639, 0.00837404 ], [ 0.03029999, 0.05232639, -0.00837404 ], [ 0.02733067, 0.01403763, 0.01213042 ], [ 0.02733067, -0.01403763, -0.01213042 ], [ -0.02733067, -0.01403763, -0.01213042 ], [ -0.02733067, 0.01403763, 0.01213042 ] ]
pbe
true
15
agm005266151-pbe-376
376
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.34406393, 7.73682828, -0.01746539 ], [ -3.34406393, 7.73682828, -0.01746539 ], [ 0, 4.26579573, 6.11202006 ] ]
agm005266151
[ [ 1.672031965, 3.86841414, -0.008732695 ], [ -1.672031965, 6.001312005, 3.047277335 ], [ 0.8141523253224636, 4.03345558879144, 2.7149866643367346 ], [ 0.8141523253224636, 13.57309883620856, 0.306092585663265 ], [ -0.8141523253224636, 15.70599670120856, 3.362102615663265 ], [ -0.8141523253224636, 6.16635345379144, 5.770996694336735 ], [ -2.5076930754357485, 11.183409965782422, 4.011436178495554 ], [ -2.5076930754357485, 10.688940189217579, 5.121663131504445 ], [ 2.5076930754357485, 8.55604232421758, 2.0656531015044455 ], [ 2.5076930754357485, 9.050512100782422, 0.9554261484955545 ], [ -1.8707577126110306, 11.093599466855876, 1.8176374212340236 ], [ -1.8707577126110304, 6.512954958144123, 1.2034418287659763 ], [ 1.8707577126110304, 8.645852823144123, 4.259451858765976 ], [ 1.8707577126110306, 13.226497331855876, 4.8736474512340235 ], [ 0.20409297021868067, 5.112661831940965, 2.500370492707538 ], [ 0.20409297021868067, 12.493892593059035, 0.5207087572924616 ], [ -0.20409297021868067, 14.626790458059036, 3.576718787292462 ], [ -0.20409297021868067, 7.2455596969409655, 5.5563805227075385 ], [ -0.9018225123935373, 14.321749533633195, 5.8631830785791115 ], [ -0.9018225123935373, 7.5506006213668035, 3.269916231420889 ], [ 0.9018225123935373, 5.417702756366804, 0.21390620142088912 ], [ 0.9018225123935373, 12.188851668633196, 2.807173048579111 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.13661391, 0, 0 ], [ 0, 1.4849077, -0.11024239 ], [ 0, -0.11024244, 2.21247143 ] ]
-146.971812
-158.491812
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01076451, -0.03735403, 0.05436992 ], [ 0.01076451, 0.03735403, -0.05436992 ], [ -0.01076451, 0.03735403, -0.05436992 ], [ -0.01076451, -0.03735403, 0.05436992 ], [ -0.01586497, 0.03414466, -0.06846619 ], [ -0.01586497, -0.03414466, 0.06846619 ], [ 0.01586497, -0.03414466, 0.06846619 ], [ 0.01586497, 0.03414466, -0.06846619 ], [ 0.02413315, -0.02557721, -0.03280782 ], [ 0.02413315, 0.02557721, 0.03280782 ], [ -0.02413315, 0.02557721, 0.03280782 ], [ -0.02413315, -0.02557721, -0.03280782 ], [ -0.03944838, 0.06528561, -0.00908339 ], [ -0.03944838, -0.06528561, 0.00908339 ], [ 0.03944838, -0.06528561, 0.00908339 ], [ 0.03944838, 0.06528561, -0.00908339 ], [ 0.02744094, 0.01062743, 0.01200871 ], [ 0.02744094, -0.01062743, -0.01200871 ], [ -0.02744094, -0.01062743, -0.01200871 ], [ -0.02744094, 0.01062743, 0.01200871 ] ]
pbe
true
15
agm005266151-pbe-377
377
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.34253922, 7.74003591, -0.01687343 ], [ -3.34253922, 7.74003591, -0.01687343 ], [ 0, 4.26803044, 6.11135866 ] ]
agm005266151
[ [ 1.67126961, 3.870017955, -0.008436715 ], [ -1.67126961, 6.004033175, 3.0472426149999996 ], [ 0.8137182098645587, 4.035166052967046, 2.7155802192381127 ], [ 0.8137182098645588, 13.578920987032953, 0.3063522507618871 ], [ -0.8137182098645588, 15.712936207032953, 3.362031580761887 ], [ -0.8137182098645587, 6.169181272967045, 5.7712595492381125 ], [ -2.50748875770644, 11.18878139041303, 4.011309345824043 ], [ -2.5074887577064406, 10.69333608958697, 5.121981784175955 ], [ 2.5074887577064406, 8.55932086958697, 2.0663024541759563 ], [ 2.50748875770644, 9.05476617041303, 0.9556300158240437 ], [ -1.8702750694743762, 11.098894795458921, 1.8182762967699824 ], [ -1.870275069474376, 6.515192244541079, 1.2036561732300173 ], [ 1.870275069474376, 8.649207464541078, 4.259335503230017 ], [ 1.8702750694743762, 13.232910015458923, 4.873955626769982 ], [ 0.20445911304033593, 5.11532422046183, 2.500331899350593 ], [ 0.20445911304033615, 12.49876281953817, 0.5216005706494067 ], [ -0.20445911304033615, 14.63277803953817, 3.577279900649407 ], [ -0.20445911304033593, 7.2493394404618305, 5.5560112293505926 ], [ -0.8993023890246172, 14.329787240026487, 5.864036781623189 ], [ -0.8993023890246175, 7.552330239973513, 3.2692543483768106 ], [ 0.8993023890246175, 5.418315019973512, 0.2135750183768109 ], [ 0.8993023890246172, 12.195772020026487, 2.8083574516231886 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.17485201, 0, 0 ], [ 0, 1.52037564, -0.00940736 ], [ 0, -0.00940738, 2.56281861 ] ]
-146.972283
-158.492283
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.0033017, 0.0021191, 0.00870834 ], [ -0.0033017, -0.0021191, -0.00870834 ], [ 0.0033017, -0.0021191, -0.00870834 ], [ 0.0033017, 0.0021191, 0.00870834 ], [ -0.01432885, -0.0132087, 0.0353493 ], [ -0.01432885, 0.0132087, -0.0353493 ], [ 0.01432885, 0.0132087, -0.0353493 ], [ 0.01432885, -0.0132087, 0.0353493 ], [ 0.02994006, -0.03689247, -0.02844062 ], [ 0.02994006, 0.03689247, 0.02844062 ], [ -0.02994006, 0.03689247, 0.02844062 ], [ -0.02994006, -0.03689247, -0.02844062 ], [ -0.0335602, 0.04810556, 0.0003251 ], [ -0.0335602, -0.04810556, -0.0003251 ], [ 0.0335602, -0.04810556, -0.0003251 ], [ 0.0335602, 0.04810556, 0.0003251 ], [ 0.02630531, 0.00509968, 0.01220341 ], [ 0.02630531, -0.00509968, -0.01220341 ], [ -0.02630531, -0.00509968, -0.01220341 ], [ -0.02630531, 0.00509968, 0.01220341 ] ]
pbe
true
15
agm005266151-pbe-378
378
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.34188649, 7.74140909, -0.01662001 ], [ -3.34188649, 7.74140909, -0.01662001 ], [ 0, 4.26898712, 6.11107552 ] ]
agm005266151
[ [ 1.670943245, 3.870704545, -0.008310005 ], [ -1.670943245, 6.005198105, 3.047227755 ], [ 0.8135323382063392, 4.035898279115527, 2.71583425277822 ], [ 0.8135323382063393, 13.581413460884475, 0.3064634872217798 ], [ -0.8135323382063393, 15.715907020884474, 3.3620012472217797 ], [ -0.8135323382063392, 6.170391839115526, 5.771372012778221 ], [ -2.5074012252975235, 11.191080889707187, 4.011255082620356 ], [ -2.5074012252975235, 10.695217970292813, 5.122118177379644 ], [ 2.5074012252975235, 8.560724410292814, 2.066580417379644 ], [ 2.5074012252975235, 9.056587329707188, 0.9557173226203559 ], [ -1.8700683818463781, 11.101161735298724, 1.818549827751238 ], [ -1.8700683818463781, 6.5161500047012755, 1.203747912248762 ], [ 1.8700683818463781, 8.650643564701275, 4.259285672248763 ], [ 1.8700683818463781, 13.235655295298724, 4.874087587751237 ], [ 0.20461582293058356, 5.116464011293106, 2.500315440760566 ], [ 0.20461582293058367, 12.500847728706896, 0.5219822992394341 ], [ -0.20461582293058367, 14.635341288706895, 3.577520059239434 ], [ -0.20461582293058356, 7.250957571293107, 5.555853200760566 ], [ -0.8982237289716504, 14.333228410641471, 5.864402288172449 ], [ -0.8982237289716505, 7.553070449358531, 3.2689709718275513 ], [ 0.8982237289716505, 5.418576889358531, 0.2134332118275511 ], [ 0.8982237289716504, 12.19873485064147, 2.8088645281724487 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.19905148, 0, 0 ], [ 0, 1.522942, 0.03026037 ], [ 0, 0.03026039, 2.70606603 ] ]
-146.972339
-158.492339
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00934488, 0.01919434, -0.01089648 ], [ -0.00934488, -0.01919434, 0.01089648 ], [ 0.00934488, -0.01919434, 0.01089648 ], [ 0.00934488, 0.01919434, -0.01089648 ], [ -0.01372899, -0.03334784, 0.07967783 ], [ -0.01372899, 0.03334784, -0.07967783 ], [ 0.01372899, 0.03334784, -0.07967783 ], [ 0.01372899, -0.03334784, 0.07967783 ], [ 0.03242587, -0.04148677, -0.02633398 ], [ 0.03242587, 0.04148677, 0.02633398 ], [ -0.03242587, 0.04148677, 0.02633398 ], [ -0.03242587, -0.04148677, -0.02633398 ], [ -0.03092438, 0.0407358, 0.00419494 ], [ -0.03092438, -0.0407358, -0.00419494 ], [ 0.03092438, -0.0407358, -0.00419494 ], [ 0.03092438, 0.0407358, 0.00419494 ], [ 0.02608186, 0.00287241, 0.01211598 ], [ 0.02608186, -0.00287241, -0.01211598 ], [ -0.02608186, -0.00287241, -0.01211598 ], [ -0.02608186, 0.00287241, 0.01211598 ] ]
pbe
true
15
agm005266151-pbe-379
379
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.53158573, 7.17078082, -0.03388645 ], [ -3.53158573, 7.17078082, -0.03388645 ], [ 0, 3.94523509, 6.09569642 ] ]
agm005266151
[ [ 1.765792865, 3.58539041, -0.016943225 ], [ -1.765792865, 5.558007955, 3.0309049850000003 ], [ 0.7878359977725867, 3.7518497084634825, 2.6807577405258236 ], [ 0.7878359977725866, 12.562329476536519, 0.2993175694741765 ], [ -0.7878359977725866, 14.534947021536517, 3.3471657794741767 ], [ -0.7878359977725867, 5.724467253463482, 5.728605950525824 ], [ -2.713650238945767, 10.36481916855503, 3.976482057075324 ], [ -2.713650238945767, 9.89459510644497, 5.099289672924677 ], [ 2.713650238945767, 7.921977561444971, 2.051441462924677 ], [ 2.713650238945767, 8.39220162355503, 0.9286338470753236 ], [ -2.017892852121183, 10.267110593492447, 1.806189178438015 ], [ -2.017892852121183, 6.0470685915075535, 1.173886131561985 ], [ 2.017892852121183, 8.019686136507554, 4.2217343415619855 ], [ 2.017892852121183, 12.239728138492447, 4.854037388438015 ], [ 0.11776796591759642, 4.786332555991676, 2.413307225312415 ], [ 0.11776796591759675, 11.527846629008325, 0.5667680846875854 ], [ -0.11776796591759675, 13.500464174008325, 3.6146162946875857 ], [ -0.11776796591759642, 6.758950100991676, 5.461155435312415 ], [ -1.077352182174972, 13.107687729766885, 5.8393748243043735 ], [ -1.0773521821749723, 7.151726545233116, 3.2363969056956274 ], [ 1.0773521821749723, 5.179109000233115, 0.18854869569562682 ], [ 1.077352182174972, 11.135070184766885, 2.791526614304373 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.51478713, 0, 0 ], [ 0, -6.93760742, 3.63179313 ], [ 0, 3.63179307, -6.49316587 ] ]
-146.820713
-158.340713
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.06760068, -0.01511618, 0.06923774 ], [ 0.06760068, 0.01511618, -0.06923774 ], [ -0.06760068, 0.01511618, -0.06923774 ], [ -0.06760068, -0.01511618, 0.06923774 ], [ -0.04565332, 0.0521225, 0.0155819 ], [ -0.04565332, -0.0521225, -0.0155819 ], [ 0.04565332, -0.0521225, -0.0155819 ], [ 0.04565332, 0.0521225, 0.0155819 ], [ 0.01365187, 0.02560405, -0.07820913 ], [ 0.01365187, -0.02560405, 0.07820913 ], [ -0.01365187, -0.02560405, 0.07820913 ], [ -0.01365187, 0.02560405, -0.07820913 ], [ 0.03210737, -0.07434677, 0.1203313 ], [ 0.03210737, 0.07434677, -0.1203313 ], [ -0.03210737, 0.07434677, -0.1203313 ], [ -0.03210737, -0.07434677, 0.1203313 ], [ 0.00020874, 0.11067724, 0.01056586 ], [ 0.00020874, -0.11067724, -0.01056586 ], [ -0.00020874, -0.11067724, -0.01056586 ], [ -0.00020874, 0.11067724, 0.01056586 ] ]
pbe
true
15
agm005266151-pbe-38
38
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.34067542, 7.7447312, -0.01615449 ], [ -3.34067542, 7.7447312, -0.01615449 ], [ 0, 4.27118815, 6.11180871 ] ]
agm005266151
[ [ 1.67033771, 3.8723656, -0.008077245 ], [ -1.67033771, 6.007959675, 3.04782711 ], [ 0.8131123796069919, 4.037824228210597, 2.71675153788526 ], [ 0.8131123796069919, 13.587232246789405, 0.30684383711474006 ], [ -0.8131123796069919, 15.722826321789405, 3.36274819211474 ], [ -0.8131123796069919, 6.173418303210598, 5.77265589288526 ], [ -2.5073219548367365, 11.196177045602697, 4.012647963336936 ], [ -2.5073219548367365, 10.700067579397304, 5.122756121663064 ], [ 2.5073219548367365, 8.564473504397304, 2.0668517666630644 ], [ 2.5073219548367365, 9.060582970602697, 0.9567436083369361 ], [ -1.8694052510091346, 11.106117362339852, 1.8192098348601005 ], [ -1.8694052510091346, 6.518939112660148, 1.2043855401398997 ], [ 1.8694052510091346, 8.65453318766015, 4.2602898951399 ], [ 1.8694052510091346, 13.241711437339852, 4.8751141898601 ], [ 0.20463641352751993, 5.1194158140978185, 2.5008346857484187 ], [ 0.20463641352752004, 12.505640660902184, 0.5227606892515814 ], [ -0.20463641352752004, 14.641234735902184, 3.5786650442515815 ], [ -0.20463641352751993, 7.255009889097819, 5.556739040748418 ], [ -0.8960747463940262, 14.341017433703275, 5.866364135938543 ], [ -0.8960747463940264, 7.555227191296726, 3.2690399490614572 ], [ 0.8960747463940264, 5.419633116296726, 0.21313559406145707 ], [ 0.8960747463940262, 12.205423358703275, 2.810459780938543 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.72445033, 0, 0 ], [ 0, 0.54474359, -0.27201377 ], [ 0, -0.27201379, 2.53056086 ] ]
-146.972843
-158.492843
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01501424, 0.03792373, -0.04063098 ], [ -0.01501424, -0.03792373, 0.04063098 ], [ 0.01501424, -0.03792373, 0.04063098 ], [ 0.01501424, 0.03792373, -0.04063098 ], [ -0.01218334, -0.00804152, 0.01939935 ], [ -0.01218334, 0.00804152, -0.01939935 ], [ 0.01218334, 0.00804152, -0.01939935 ], [ 0.01218334, -0.00804152, 0.01939935 ], [ 0.01491029, -0.02581796, 0.00289851 ], [ 0.01491029, 0.02581796, -0.00289851 ], [ -0.01491029, 0.02581796, -0.00289851 ], [ -0.01491029, -0.02581796, 0.00289851 ], [ -0.00895327, 0.00002932, 0.01375578 ], [ -0.00895327, -0.00002932, -0.01375578 ], [ 0.00895327, -0.00002932, -0.01375578 ], [ 0.00895327, 0.00002932, 0.01375578 ], [ 0.02293496, 0.00331928, 0.01193243 ], [ 0.02293496, -0.00331928, -0.01193243 ], [ -0.02293496, -0.00331928, -0.01193243 ], [ -0.02293496, 0.00331928, 0.01193243 ] ]
pbe
true
15
agm005266151-pbe-380
380
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.33952013, 7.74790031, -0.01571041 ], [ -3.33952013, 7.74790031, -0.01571041 ], [ 0, 4.27328782, 6.11250814 ] ]
agm005266151
[ [ 1.669760065, 3.873950155, -0.007855205 ], [ -1.669760065, 6.010594065, 3.0483988650000002 ], [ 0.8127117969490406, 4.039661374715011, 2.7176265311341865 ], [ 0.8127117969490407, 13.59278315528499, 0.30720671886581347 ], [ -0.8127117969490407, 15.72942706528499, 3.3634607888658135 ], [ -0.8127117969490406, 6.17630528471501, 5.773880601134187 ], [ -2.5072461254286464, 11.20103849065811, 4.013976787721113 ], [ -2.507246125428647, 10.70469385934189, 5.123364602278888 ], [ 2.507246125428647, 8.56804994934189, 2.0671105322788876 ], [ 2.5072461254286464, 9.06439458065811, 0.9577227177211124 ], [ -1.8687725890351097, 11.110844871219122, 1.8198394657460037 ], [ -1.8687725890351092, 6.521599658780878, 1.2049937842539962 ], [ 1.8687725890351092, 8.658243568780879, 4.261247854253996 ], [ 1.8687725890351097, 13.247488781219122, 4.876093535746004 ], [ 0.20465597910279654, 5.12223196141682, 2.501330092323169 ], [ 0.20465597910279687, 12.510212568583182, 0.5235031576768306 ], [ -0.20465597910279687, 14.646856478583182, 3.5797572276768306 ], [ -0.20465597910279654, 7.258875871416821, 5.557584162323169 ], [ -0.8940253718519948, 14.348448231756219, 5.868235710921616 ], [ -0.8940253718519948, 7.557284118243784, 3.269105679078384 ], [ 0.8940253718519948, 5.420640208243783, 0.21285160907838432 ], [ 0.8940253718519948, 12.211804321756219, 2.811981640921616 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.21735099, 0, 0 ], [ 0, -0.38811815, -0.56390508 ], [ 0, -0.56390502, 2.36945462 ] ]
-146.973023
-158.493023
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02037894, 0.05569026, -0.06892504 ], [ -0.02037894, -0.05569026, 0.06892504 ], [ 0.02037894, -0.05569026, 0.06892504 ], [ 0.02037894, 0.05569026, -0.06892504 ], [ -0.01078875, 0.01632565, -0.03843686 ], [ -0.01078875, -0.01632565, 0.03843686 ], [ 0.01078875, -0.01632565, 0.03843686 ], [ 0.01078875, 0.01632565, -0.03843686 ], [ -0.00185265, -0.01083689, 0.03084207 ], [ -0.00185265, 0.01083689, -0.03084207 ], [ 0.00185265, 0.01083689, -0.03084207 ], [ 0.00185265, -0.01083689, 0.03084207 ], [ 0.01195448, -0.03876558, 0.02281432 ], [ 0.01195448, 0.03876558, -0.02281432 ], [ -0.01195448, 0.03876558, -0.02281432 ], [ -0.01195448, -0.03876558, 0.02281432 ], [ 0.0199934, 0.00391824, 0.01179485 ], [ 0.0199934, -0.00391824, -0.01179485 ], [ -0.0199934, -0.00391824, -0.01179485 ], [ -0.0199934, 0.00391824, 0.01179485 ] ]
pbe
true
15
agm005266151-pbe-381
381
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.33784284, 7.75125589, -0.01559258 ], [ -3.33784284, 7.75125589, -0.01559258 ], [ 0, 4.27523531, 6.11437446 ] ]
agm005266151
[ [ 1.66892142, 3.875627945, -0.00779629 ], [ -1.66892142, 6.0132456, 3.04939094 ], [ 0.8119669203443833, 4.0420344653682525, 2.718315485313527 ], [ 0.8119669203443833, 13.598094969631749, 0.30768658468647253 ], [ -0.8119669203443833, 15.735712624631748, 3.3648738146864723 ], [ -0.8119669203443833, 6.179652120368253, 5.775502715313528 ], [ -2.506996012442868, 11.206168898262195, 4.0153987806115845 ], [ -2.506996012442868, 10.709195846737805, 5.124977749388414 ], [ 2.506996012442868, 8.571578191737805, 2.0677905193884145 ], [ 2.506996012442868, 9.068551243262196, 0.9582115506115851 ], [ -1.8678680350375136, 11.11566717856185, 1.8206897003224911 ], [ -1.8678680350375139, 6.524462256438149, 1.2053123696775088 ], [ 1.8678680350375139, 8.662079911438148, 4.262499599677509 ], [ 1.8678680350375136, 13.25328483356185, 4.877876930322491 ], [ 0.20477385444601437, 5.12476692765364, 2.5023891103513836 ], [ 0.2047738544460147, 12.515362507346362, 0.5236129596486164 ], [ -0.2047738544460147, 14.652980162346362, 3.5808001896486163 ], [ -0.20477385444601437, 7.26238458265364, 5.559576340351383 ], [ -0.8913943954571653, 14.356190864191117, 5.871003483073898 ], [ -0.8913943954571651, 7.559173880808884, 3.269373046926101 ], [ 0.8913943954571651, 5.421556225808884, 0.2121858169261014 ], [ 0.8913943954571653, 12.218573209191117, 2.813816253073899 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.32068031, 0, 0 ], [ 0, -0.52821512, -0.31969446 ], [ 0, -0.3196945, 0.78633072 ] ]
-146.973627
-158.493627
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00543474, 0.02109978, -0.0547801 ], [ -0.00543474, -0.02109978, 0.0547801 ], [ 0.00543474, -0.02109978, 0.0547801 ], [ 0.00543474, 0.02109978, -0.0547801 ], [ -0.00864558, 0.00717028, -0.02353248 ], [ -0.00864558, -0.00717028, 0.02353248 ], [ 0.00864558, -0.00717028, 0.02353248 ], [ 0.00864558, 0.00717028, -0.02353248 ], [ -0.01387644, 0.00509483, 0.04007377 ], [ -0.01387644, -0.00509483, -0.04007377 ], [ 0.01387644, -0.00509483, -0.04007377 ], [ 0.01387644, 0.00509483, 0.04007377 ], [ 0.00743231, -0.03016777, 0.01640952 ], [ 0.00743231, 0.03016777, -0.01640952 ], [ -0.00743231, 0.03016777, -0.01640952 ], [ -0.00743231, -0.03016777, 0.01640952 ], [ 0.01669875, 0.00427691, 0.01120464 ], [ 0.01669875, -0.00427691, -0.01120464 ], [ -0.01669875, -0.00427691, -0.01120464 ], [ -0.01669875, 0.00427691, 0.01120464 ] ]
pbe
true
15
agm005266151-pbe-382
382
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.33536867, 7.75620568, -0.01541876 ], [ -3.33536867, 7.75620568, -0.01541876 ], [ 0, 4.27810803, 6.11712746 ] ]
agm005266151
[ [ 1.667684335, 3.87810284, -0.00770938 ], [ -1.667684335, 6.017156855, 3.05085435 ], [ 0.8108685483452804, 4.04553554470599, 2.71933166556409 ], [ 0.81086854834528, 13.60592983029401, 0.3083945444359098 ], [ -0.81086854834528, 15.744983845294009, 3.36695827443591 ], [ -0.8108685483452804, 6.18458955970599, 5.777895395564091 ], [ -2.506625947659563, 11.21373685674196, 4.017496392204354 ], [ -2.5066259476595625, 10.715836548258041, 5.127357277795646 ], [ 2.5066259476595625, 8.57678253325804, 2.068793547795646 ], [ 2.506625947659563, 9.074682841741959, 0.9589326622043537 ], [ -1.866533678515528, 11.122780597475266, 1.8219439799164645 ], [ -1.8665336785155275, 6.528684777524733, 1.2057822300835357 ], [ 1.8665336785155275, 8.667738792524734, 4.264345960083536 ], [ 1.866533678515528, 13.261834612475266, 4.880507709916464 ], [ 0.20494753146963574, 5.128506652898727, 2.5039514907774905 ], [ 0.20494753146963562, 12.522958722101272, 0.5237747192225096 ], [ -0.20494753146963562, 14.662012737101271, 3.5823384492225094 ], [ -0.20494753146963574, 7.267560667898727, 5.56251522077749 ], [ -0.8875158873945546, 14.367613375680373, 5.875086802859019 ], [ -0.8875158873945543, 7.561960029319628, 3.269766867140981 ], [ 0.8875158873945543, 5.4229060143196275, 0.2112031371409808 ], [ 0.8875158873945546, 12.228559360680372, 2.816523072859019 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.46382906, 0, 0 ], [ 0, -0.71308252, 0.04062778 ], [ 0, 0.04062771, -1.51330516 ] ]
-146.97408
-158.49408
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01660276, -0.03038361, -0.03350791 ], [ 0.01660276, 0.03038361, 0.03350791 ], [ -0.01660276, 0.03038361, 0.03350791 ], [ -0.01660276, -0.03038361, -0.03350791 ], [ -0.00526792, -0.00654461, -0.00140245 ], [ -0.00526792, 0.00654461, 0.00140245 ], [ 0.00526792, 0.00654461, 0.00140245 ], [ 0.00526792, -0.00654461, -0.00140245 ], [ -0.03154211, 0.02846734, 0.05306425 ], [ -0.03154211, -0.02846734, -0.05306425 ], [ 0.03154211, -0.02846734, -0.05306425 ], [ 0.03154211, 0.02846734, 0.05306425 ], [ 0.00045026, -0.01727275, 0.00717131 ], [ 0.00045026, 0.01727275, -0.00717131 ], [ -0.00045026, 0.01727275, -0.00717131 ], [ -0.00045026, -0.01727275, 0.00717131 ], [ 0.0118325, 0.0053257, 0.01059121 ], [ 0.0118325, -0.0053257, -0.01059121 ], [ -0.0118325, -0.0053257, -0.01059121 ], [ -0.0118325, 0.0053257, 0.01059121 ] ]
pbe
true
15
agm005266151-pbe-383
383
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.33444174, 7.7580601, -0.01535364 ], [ -3.33444174, 7.7580601, -0.01535364 ], [ 0, 4.27918428, 6.11815886 ] ]
agm005266151
[ [ 1.66722087, 3.87903005, -0.00767682 ], [ -1.66722087, 6.01862219, 3.0514026100000002 ], [ 0.8104571052343794, 4.046847264258572, 2.719712342723081 ], [ 0.810457105234379, 13.608865075741427, 0.3086598072769192 ], [ -0.810457105234379, 15.748457215741427, 3.3677392372769193 ], [ -0.8104571052343794, 6.1864394042585715, 5.778791772723081 ], [ -2.5064871517349703, 11.216572188705399, 4.018282288160092 ], [ -2.5064871517349707, 10.718324431294603, 5.128248721839909 ], [ 2.5064871517349707, 8.578732291294603, 2.0691692918399087 ], [ 2.5064871517349703, 9.076980048705398, 0.9592028581600917 ], [ -1.8660337576834296, 11.12544558289537, 1.8224138927025082 ], [ -1.8660337576834296, 6.530266757104631, 1.205958257297492 ], [ 1.8660337576834296, 8.66985889710463, 4.265037687297492 ], [ 1.8660337576834296, 13.26503772289537, 4.881493322702508 ], [ 0.2050125818661942, 5.129907716211729, 2.5045368729266317 ], [ 0.2050125818661943, 12.525804623788268, 0.5238352770733684 ], [ -0.2050125818661943, 14.66539676378827, 3.5829147070733685 ], [ -0.2050125818661942, 7.269499856211731, 5.563616302926632 ], [ -0.886063137546409, 14.371892929726716, 5.8766166788117955 ], [ -0.8860631375464092, 7.563003690273284, 3.269914331188205 ], [ 0.8860631375464092, 5.423411550273284, 0.21083490118820442 ], [ 0.886063137546409, 12.232300789726716, 2.8175372488117953 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.50745175, 0, 0 ], [ 0, -0.78132175, 0.17552244 ], [ 0, 0.17552244, -2.38330172 ] ]
-146.974113
-158.494113
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.02474206, -0.04909126, -0.0257437 ], [ 0.02474206, 0.04909126, 0.0257437 ], [ -0.02474206, 0.04909126, 0.0257437 ], [ -0.02474206, -0.04909126, -0.0257437 ], [ -0.00409281, -0.0115231, 0.00700546 ], [ -0.00409281, 0.0115231, -0.00700546 ], [ 0.00409281, 0.0115231, -0.00700546 ], [ 0.00409281, -0.0115231, 0.00700546 ], [ -0.03774801, 0.03766102, 0.0577334 ], [ -0.03774801, -0.03766102, -0.0577334 ], [ 0.03774801, -0.03766102, -0.0577334 ], [ 0.03774801, 0.03766102, 0.0577334 ], [ -0.00224386, -0.01228718, 0.00340337 ], [ -0.00224386, 0.01228718, -0.00340337 ], [ 0.00224386, 0.01228718, -0.00340337 ], [ 0.00224386, -0.01228718, 0.00340337 ], [ 0.00986705, 0.00604582, 0.00997052 ], [ 0.00986705, -0.00604582, -0.00997052 ], [ -0.00986705, -0.00604582, -0.00997052 ], [ -0.00986705, 0.00604582, 0.00997052 ] ]
pbe
true
15
agm005266151-pbe-384
384
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.33172055, 7.76151128, -0.01503193 ], [ -3.33172055, 7.76151128, -0.01503193 ], [ 0, 4.28134281, 6.118777 ] ]
agm005266151
[ [ 1.665860275, 3.88075564, -0.007515965 ], [ -1.665860275, 6.021427044999999, 3.0518725349999998 ], [ 0.8097163412506695, 4.048808205945405, 2.719501797755282 ], [ 0.8097163412506698, 13.614885759054594, 0.3098228422447177 ], [ -0.8097163412506698, 15.755557164054593, 3.3692113422447174 ], [ -0.8097163412506695, 6.189479610945405, 5.778890297755282 ], [ -2.5057608383314767, 11.221840304032876, 4.0192146626345195 ], [ -2.505760838331477, 10.723196470967125, 5.12888697736548 ], [ 2.505760838331477, 8.582525065967124, 2.0694984773654808 ], [ 2.5057608383314767, 9.081168899032876, 0.9598261626345191 ], [ -1.865075107899959, 11.130969051359465, 1.8239804781607678 ], [ -1.8650751078999588, 6.532724913640535, 1.2053441618392322 ], [ 1.8650751078999588, 8.673396318640535, 4.264732661839232 ], [ 1.865075107899959, 13.271640456359465, 4.883368978160767 ], [ 0.20509035540708942, 5.132470972814391, 2.505280363284426 ], [ 0.2050903554070893, 12.531222992185608, 0.5240442767155736 ], [ -0.2050903554070893, 14.671894397185607, 3.5834327767155734 ], [ -0.20509035540708942, 7.273142377814391, 5.564668863284426 ], [ -0.8824736216914322, 14.380412017200527, 5.878794107325424 ], [ -0.882473621691432, 7.564624757799473, 3.269307532674575 ], [ 0.882473621691432, 5.423953352799473, 0.20991903267457498 ], [ 0.8824736216914322, 12.239740612200526, 2.819405607325425 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -1.0586862, 0, 0 ], [ 0, -0.00380724, 0.85896303 ], [ 0, 0.85896299, -1.85821676 ] ]
-146.974638
-158.494638
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00196632, -0.04297572, 0.04445453 ], [ -0.00196632, 0.04297572, -0.04445453 ], [ 0.00196632, 0.04297572, -0.04445453 ], [ 0.00196632, -0.04297572, 0.04445453 ], [ -0.00270715, -0.00273872, -0.01451637 ], [ -0.00270715, 0.00273872, 0.01451637 ], [ 0.00270715, 0.00273872, 0.01451637 ], [ 0.00270715, -0.00273872, -0.01451637 ], [ -0.00666126, 0.01105363, 0.00758414 ], [ -0.00666126, -0.01105363, -0.00758414 ], [ 0.00666126, -0.01105363, -0.00758414 ], [ 0.00666126, 0.01105363, 0.00758414 ], [ -0.00990753, 0.00144023, -0.00497901 ], [ -0.00990753, -0.00144023, 0.00497901 ], [ 0.00990753, -0.00144023, 0.00497901 ], [ 0.00990753, 0.00144023, -0.00497901 ], [ 0.00845464, 0.00184419, 0.00867821 ], [ 0.00845464, -0.00184419, -0.00867821 ], [ -0.00845464, -0.00184419, -0.00867821 ], [ -0.00845464, 0.00184419, 0.00867821 ] ]
pbe
true
15
agm005266151-pbe-385
385
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.33049972, 7.76305961, -0.0148876 ], [ -3.33049972, 7.76305961, -0.0148876 ], [ 0, 4.2823112, 6.11905432 ] ]
agm005266151
[ [ 1.66524986, 3.881529805, -0.0074438 ], [ -1.66524986, 6.022685405, 3.05208336 ], [ 0.8093840035488987, 4.0496880391886, 2.71940733902117 ], [ 0.8093840035488991, 13.617586780811399, 0.31034462097882964 ], [ -0.8093840035488991, 15.7587423808114, 3.36987178097883 ], [ -0.8093840035488987, 6.1908436391886, 5.778934499021171 ], [ -2.5054347579244225, 11.224203721502905, 4.019632984638964 ], [ -2.5054347579244225, 10.725382298497093, 5.129173295361037 ], [ 2.5054347579244225, 8.584226698497094, 2.069646135361036 ], [ 2.5054347579244225, 9.083048121502905, 0.960105824638964 ], [ -1.864644879936568, 11.133447047773492, 1.8246832788760257 ], [ -1.8646448799365678, 6.533827772226508, 1.2050686811239744 ], [ 1.8646448799365678, 8.674983372226508, 4.264595841123974 ], [ 1.864644879936568, 13.274602647773492, 4.884210438876026 ], [ 0.2051252446198195, 5.133620978683489, 2.5056139160434974 ], [ 0.20512524461981974, 12.533653841316513, 0.5241380439565032 ], [ -0.20512524461981974, 14.674809441316512, 3.583665203956503 ], [ -0.2051252446198195, 7.274776578683489, 5.5651410760434965 ], [ -0.8808637214194941, 14.384234203714133, 5.8797709459501615 ], [ -0.880863721419494, 7.565351816285867, 3.2690353340498386 ], [ 0.880863721419494, 5.424196216285867, 0.2095081740498392 ], [ 0.8808637214194941, 12.243078603714133, 2.8202437859501606 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.8400524, 0, 0 ], [ 0, 0.365806, 1.16745089 ], [ 0, 1.1674509, -1.60417677 ] ]
-146.9747
-158.4947
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01413589, -0.04009516, 0.07604731 ], [ -0.01413589, 0.04009516, -0.07604731 ], [ 0.01413589, 0.04009516, -0.07604731 ], [ 0.01413589, -0.04009516, 0.07604731 ], [ -0.00220029, 0.00119973, -0.02402701 ], [ -0.00220029, -0.00119973, 0.02402701 ], [ 0.00220029, -0.00119973, 0.02402701 ], [ 0.00220029, 0.00119973, -0.02402701 ], [ 0.0072248, -0.00089346, -0.01510252 ], [ 0.0072248, 0.00089346, 0.01510252 ], [ -0.0072248, 0.00089346, 0.01510252 ], [ -0.0072248, -0.00089346, -0.01510252 ], [ -0.01358264, 0.00765875, -0.00864748 ], [ -0.01358264, -0.00765875, 0.00864748 ], [ 0.01358264, -0.00765875, 0.00864748 ], [ 0.01358264, 0.00765875, -0.00864748 ], [ 0.00755769, 0.00038104, 0.0081587 ], [ 0.00755769, -0.00038104, -0.0081587 ], [ -0.00755769, -0.00038104, -0.0081587 ], [ -0.00755769, 0.00038104, 0.0081587 ] ]
pbe
true
15
agm005266151-pbe-386
386
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.32785585, 7.76631966, -0.01338843 ], [ -3.32785585, 7.76631966, -0.01338843 ], [ 0, 4.28529096, 6.11891712 ] ]
agm005266151
[ [ 1.663927925, 3.88315983, -0.006694215 ], [ -1.663927925, 6.02580531, 3.052764345 ], [ 0.8084625113730661, 4.051349594582493, 2.7204272776964777 ], [ 0.8084625113730661, 13.623935205417508, 0.3122544223035222 ], [ -0.8084625113730661, 15.766580685417509, 3.3717129823035217 ], [ -0.8084625113730661, 6.193995074582492, 5.779885837696478 ], [ -2.5045782901182285, 11.229806391661526, 4.020949787534021 ], [ -2.5045782901182285, 10.730769368338475, 5.130649032465978 ], [ 2.5045782901182285, 8.588123888338474, 2.071190472465979 ], [ 2.5045782901182285, 9.087160911661528, 0.961491227534021 ], [ -1.8635260298927416, 11.138879591089562, 1.8271255499267032 ], [ -1.8635260298927419, 6.536405208910438, 1.2055561500732968 ], [ 1.8635260298927419, 8.679050688910438, 4.265014710073297 ], [ 1.8635260298927416, 13.281525071089561, 4.8865841099267024 ], [ 0.20496210934456405, 5.136524420642428, 2.5063706894233837 ], [ 0.20496210934456416, 12.538760379357571, 0.5263110105766164 ], [ -0.20496210934456416, 14.68140585935757, 3.585769570576616 ], [ -0.20496210934456405, 7.279169900642429, 5.565829249423384 ], [ -0.8776620457536415, 14.392986237168857, 5.882705983802313 ], [ -0.8776620457536415, 7.567589522831143, 3.268892836197687 ], [ 0.8776620457536415, 5.424944042831142, 0.20943427619768668 ], [ 0.8776620457536415, 12.250340757168857, 2.823247423802313 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.77423231, 0, 0 ], [ 0, 0.34005281, 1.10071523 ], [ 0, 1.10071521, -0.40502025 ] ]
-146.975219
-158.495219
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.03571929, 0.01081481, 0.04368575 ], [ -0.03571929, -0.01081481, -0.04368575 ], [ 0.03571929, -0.01081481, -0.04368575 ], [ 0.03571929, 0.01081481, 0.04368575 ], [ -0.00178855, -0.02335995, 0.0316516 ], [ -0.00178855, 0.02335995, -0.0316516 ], [ 0.00178855, 0.02335995, -0.0316516 ], [ 0.00178855, -0.02335995, 0.0316516 ], [ 0.01720712, -0.01525149, -0.02423873 ], [ 0.01720712, 0.01525149, 0.02423873 ], [ -0.01720712, 0.01525149, 0.02423873 ], [ -0.01720712, -0.01525149, -0.02423873 ], [ -0.00212148, -0.01614036, -0.00237672 ], [ -0.00212148, 0.01614036, 0.00237672 ], [ 0.00212148, 0.01614036, 0.00237672 ], [ 0.00212148, -0.01614036, -0.00237672 ], [ 0.00588131, -0.00117242, 0.00829547 ], [ 0.00588131, 0.00117242, -0.00829547 ], [ -0.00588131, 0.00117242, -0.00829547 ], [ -0.00588131, -0.00117242, 0.00829547 ] ]
pbe
true
15
agm005266151-pbe-387
387
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.32612947, 7.76844838, -0.0124095 ], [ -3.32612947, 7.76844838, -0.0124095 ], [ 0, 4.28723667, 6.11882752 ] ]
agm005266151
[ [ 1.663064735, 3.88422419, -0.00620475 ], [ -1.663064735, 6.0278425250000005, 3.05320901 ], [ 0.8078608695040199, 4.052434503486083, 2.7210931521846473 ], [ 0.8078608695040197, 13.628080591513918, 0.313501607815353 ], [ -0.8078608695040197, 15.771698926513917, 3.3729153678153527 ], [ -0.8078608695040199, 6.196052838486083, 5.780506912184647 ], [ -2.5040186968367224, 11.23346476177107, 4.021809629011049 ], [ -2.504018696836722, 10.734287003228932, 5.131612650988951 ], [ 2.504018696836722, 8.59066866822893, 2.0721988909889513 ], [ 2.5040186968367224, 9.08984642677107, 0.9623958690110483 ], [ -1.8627953172375566, 11.14242707981467, 1.8287203289970713 ], [ -1.8627953172375569, 6.5380880151853304, 1.205874431002929 ], [ 1.8627953172375569, 8.68170635018533, 4.265288191002929 ], [ 1.8627953172375566, 13.28604541481467, 4.888134088997071 ], [ 0.20485561557011134, 5.138420479967752, 2.5068649189077874 ], [ 0.20485561557011112, 12.542094615032248, 0.5277298410922127 ], [ -0.20485561557011112, 14.685712950032249, 3.587143601092212 ], [ -0.20485561557011134, 7.282038814967752, 5.566278678907787 ], [ -0.8755723173604821, 14.398701480072257, 5.8846225422730845 ], [ -0.8755723173604819, 7.5690502849277435, 3.268799737726915 ], [ 0.8755723173604819, 5.425431949927743, 0.2093859777269152 ], [ 0.8755723173604821, 12.255083145072255, 2.8252087822730845 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.7467414, 0, 0 ], [ 0, 0.30609607, 1.0593757 ], [ 0, 1.0593757, 0.36236018 ] ]
-146.975343
-158.495343
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.04992925, 0.04404583, 0.02273811 ], [ -0.04992925, -0.04404583, -0.02273811 ], [ 0.04992925, -0.04404583, -0.02273811 ], [ 0.04992925, 0.04404583, 0.02273811 ], [ -0.00171962, -0.03949604, 0.06831618 ], [ -0.00171962, 0.03949604, -0.06831618 ], [ 0.00171962, 0.03949604, -0.06831618 ], [ 0.00171962, -0.03949604, 0.06831618 ], [ 0.02354078, -0.02468153, -0.02961774 ], [ 0.02354078, 0.02468153, 0.02961774 ], [ -0.02354078, 0.02468153, 0.02961774 ], [ -0.02354078, -0.02468153, -0.02961774 ], [ 0.0054859, -0.03183912, 0.00171937 ], [ 0.0054859, 0.03183912, -0.00171937 ], [ -0.0054859, 0.03183912, -0.00171937 ], [ -0.0054859, -0.03183912, 0.00171937 ], [ 0.00476421, -0.00248459, 0.00833628 ], [ 0.00476421, 0.00248459, -0.00833628 ], [ -0.00476421, 0.00248459, -0.00833628 ], [ -0.00476421, -0.00248459, 0.00833628 ] ]
pbe
true
15
agm005266151-pbe-388
388
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.32391453, 7.77112951, -0.01061043 ], [ -3.32391453, 7.77112951, -0.01061043 ], [ 0, 4.29013405, 6.11925995 ] ]
agm005266151
[ [ 1.661957265, 3.885564755, -0.005305215 ], [ -1.661957265, 6.03063178, 3.05432476 ], [ 0.8066686517585202, 4.054422200876184, 2.722492913973331 ], [ 0.8066686517585202, 13.632903844123817, 0.31591620102666873 ], [ -0.8066686517585202, 15.777970869123816, 3.3755461760266687 ], [ -0.8066686517585202, 6.199489225876183, 5.782122888973332 ], [ -2.503231888952402, 11.238011638912159, 4.024481026021646 ], [ -2.5032318889524015, 10.739448456087839, 5.1331880389783535 ], [ 2.5032318889524015, 8.59438143108784, 2.0735580639783544 ], [ 2.503231888952402, 9.09294461391216, 0.964851051021646 ], [ -1.8616230823815443, 11.146788316925296, 1.8313153405177656 ], [ -1.8616230823815447, 6.540537728074703, 1.2070937744822343 ], [ 1.8616230823815447, 8.685604753074703, 4.266723749482234 ], [ 1.8616230823815443, 13.291855341925295, 4.890945315517765 ], [ 0.2047674611196244, 5.140695174028128, 2.507963159708131 ], [ 0.20476746111962418, 12.546630870971873, 0.5304459552918693 ], [ -0.20476746111962418, 14.691697895971872, 3.5900759302918694 ], [ -0.2047674611196244, 7.285762199028127, 5.56759313470813 ], [ -0.873034560808261, 14.406217826534032, 5.888320897759144 ], [ -0.8730345608082608, 7.5712422684659675, 3.269348167240856 ], [ 0.8730345608082608, 5.426175243465967, 0.2097181922408564 ], [ 0.873034560808261, 12.261150801534031, 2.8286909227591437 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.70714416, 0, 0 ], [ 0, 0.75064609, 0.09278219 ], [ 0, 0.09278217, 1.55471564 ] ]
-146.975722
-158.495722
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02819117, 0.03020983, -0.0102099 ], [ -0.02819117, -0.03020983, 0.0102099 ], [ 0.02819117, -0.03020983, 0.0102099 ], [ 0.02819117, 0.03020983, -0.0102099 ], [ -0.0015342, 0.00427661, -0.03019889 ], [ -0.0015342, -0.00427661, 0.03019889 ], [ 0.0015342, -0.00427661, 0.03019889 ], [ 0.0015342, 0.00427661, -0.03019889 ], [ 0.00923439, -0.01534712, -0.00735479 ], [ 0.00923439, 0.01534712, 0.00735479 ], [ -0.00923439, 0.01534712, 0.00735479 ], [ -0.00923439, -0.01534712, -0.00735479 ], [ 0.00098249, -0.02613795, 0.00151977 ], [ 0.00098249, 0.02613795, -0.00151977 ], [ -0.00098249, 0.02613795, -0.00151977 ], [ -0.00098249, -0.02613795, 0.00151977 ], [ 0.00292556, -0.00229959, 0.00920893 ], [ 0.00292556, 0.00229959, -0.00920893 ], [ -0.00292556, 0.00229959, -0.00920893 ], [ -0.00292556, -0.00229959, 0.00920893 ] ]
pbe
true
15
agm005266151-pbe-389
389
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.54011563, 7.15717972, -0.0231601 ], [ -3.54011563, 7.15717972, -0.0231601 ], [ 0, 3.94688286, 6.09837446 ] ]
agm005266151
[ [ 1.770057815, 3.57858986, -0.01158005 ], [ -1.770057815, 5.55203129, 3.0376071799999997 ], [ 0.7892773467883247, 3.7488589190708934, 2.684402672991492 ], [ 0.7892773467883241, 12.538941950929107, 0.3184643570085082 ], [ -0.7892773467883241, 14.512383380929107, 3.367651587008508 ], [ -0.7892773467883247, 5.722300349070894, 5.733589902991492 ], [ -2.721396734568999, 10.354161058216123, 3.990182989470469 ], [ -2.7213967345689984, 9.880522671783877, 5.111058500529531 ], [ 2.7213967345689984, 7.907081241783877, 2.0618712705295312 ], [ 2.721396734568999, 8.380719628216124, 0.9409957594704688 ], [ -2.0238408808591575, 10.250726293624762, 1.8209038945971006 ], [ -2.0238408808591575, 6.037074576375238, 1.1819631354028994 ], [ 2.0238408808591575, 8.010516006375237, 4.231150365402899 ], [ 2.0238408808591575, 12.224167723624763, 4.8700911245971 ], [ 0.11450581887778855, 4.779253182232945, 2.417364304222594 ], [ 0.11450581887778855, 11.508547687767058, 0.5855027257774059 ], [ -0.11450581887778855, 13.481989117767057, 3.6346899557774055 ], [ -0.11450581887778855, 6.752694612232945, 5.466551534222593 ], [ -1.085212746459674, 13.090279831059368, 5.860576627535534 ], [ -1.0852127464596735, 7.1444038989406335, 3.2406648624644663 ], [ 1.0852127464596735, 5.170962468940633, 0.1914776324644666 ], [ 1.085212746459674, 11.116838401059367, 2.811389397535533 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.98948392, 0, 0 ], [ 0, -3.0363051, 1.31792895 ], [ 0, 1.31792898, -3.0264143 ] ]
-146.822605
-158.342605
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.05860319, -0.00996076, 0.02829036 ], [ 0.05860319, 0.00996076, -0.02829036 ], [ -0.05860319, 0.00996076, -0.02829036 ], [ -0.05860319, -0.00996076, 0.02829036 ], [ -0.02055969, -0.00381806, 0.04523637 ], [ -0.02055969, 0.00381806, -0.04523637 ], [ 0.02055969, 0.00381806, -0.04523637 ], [ 0.02055969, -0.00381806, 0.04523637 ], [ 0.01420473, 0.02180744, -0.0611075 ], [ 0.01420473, -0.02180744, 0.0611075 ], [ -0.01420473, -0.02180744, 0.0611075 ], [ -0.01420473, 0.02180744, -0.0611075 ], [ 0.01607381, -0.01684825, 0.07406948 ], [ 0.01607381, 0.01684825, -0.07406948 ], [ -0.01607381, 0.01684825, -0.07406948 ], [ -0.01607381, -0.01684825, 0.07406948 ], [ 0.02929566, 0.05762064, 0.00106778 ], [ 0.02929566, -0.05762064, -0.00106778 ], [ -0.02929566, -0.05762064, -0.00106778 ], [ -0.02929566, 0.05762064, 0.00106778 ] ]
pbe
true
15
agm005266151-pbe-39
39
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.32320103, 7.77199318, -0.0100309 ], [ -3.32320103, 7.77199318, -0.0100309 ], [ 0, 4.29106739, 6.11939924 ] ]
agm005266151
[ [ 1.661600515, 3.88599659, -0.00501545 ], [ -1.661600515, 6.0315302850000005, 3.05468417 ], [ 0.8062846711815869, 4.055062446245563, 2.7229437826468486 ], [ 0.806284671181587, 13.634457608754438, 0.31669403735315116 ], [ -0.806284671181587, 15.77999130375444, 3.3763936573531512 ], [ -0.8062846711815869, 6.200596141245562, 5.782643402646849 ], [ -2.5029784216824593, 11.239476341246135, 4.025341549177742 ], [ -2.502978421682459, 10.741111103753866, 5.133695510822259 ], [ 2.502978421682459, 8.595577408753865, 2.0739958908222587 ], [ 2.5029784216824593, 9.093942646246136, 0.9656419291777415 ], [ -1.8612454723983831, 11.148193179962213, 1.8321512805457654 ], [ -1.861245472398383, 6.541326875037785, 1.2074865394542342 ], [ 1.861245472398383, 8.686860570037785, 4.267186159454234 ], [ 1.8612454723983831, 13.293726874962214, 4.891850900545766 ], [ 0.20473902579324943, 5.14142787528578, 2.5083169143342143 ], [ 0.20473902579324887, 12.548092179714219, 0.5313209056657855 ], [ -0.20473902579324887, 14.69362587471422, 3.5910205256657854 ], [ -0.20473902579324943, 7.28696157028578, 5.568016534334214 ], [ -0.8722172122408591, 14.408639185009754, 5.889512297444469 ], [ -0.8722172122408591, 7.571948259990245, 3.2695247625555317 ], [ 0.8722172122408591, 5.426414564990245, 0.20982514255553178 ], [ 0.8722172122408591, 12.263105490009755, 2.829812677444468 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.69558618, 0, 0 ], [ 0, 0.87296508, -0.22271621 ], [ 0, -0.22271627, 1.93394664 ] ]
-146.97575
-158.49575
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02168344, 0.0262691, -0.0205298 ], [ -0.02168344, -0.0262691, 0.0205298 ], [ 0.02168344, -0.0262691, 0.0205298 ], [ 0.02168344, 0.0262691, -0.0205298 ], [ -0.00173609, 0.01838459, -0.0618486 ], [ -0.00173609, -0.01838459, 0.0618486 ], [ 0.00173609, -0.01838459, 0.0618486 ], [ 0.00173609, 0.01838459, -0.0618486 ], [ 0.00458765, -0.01222224, 0.00002413 ], [ 0.00458765, 0.01222224, -0.00002413 ], [ -0.00458765, 0.01222224, -0.00002413 ], [ -0.00458765, -0.01222224, 0.00002413 ], [ -0.00029621, -0.02441511, 0.00137883 ], [ -0.00029621, 0.02441511, -0.00137883 ], [ 0.00029621, 0.02441511, -0.00137883 ], [ 0.00029621, -0.02441511, 0.00137883 ], [ 0.00254489, -0.00230014, 0.00928012 ], [ 0.00254489, 0.00230014, -0.00928012 ], [ -0.00254489, 0.00230014, -0.00928012 ], [ -0.00254489, -0.00230014, 0.00928012 ] ]
pbe
true
15
agm005266151-pbe-390
390
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.32145968, 7.77444077, -0.00892133 ], [ -3.32145968, 7.77444077, -0.00892133 ], [ 0, 4.29329396, 6.12062063 ] ]
agm005266151
[ [ 1.66072984, 3.887220385, -0.004460665 ], [ -1.66072984, 6.033867365, 3.0558496500000003 ], [ 0.8052011096745616, 4.056947010400621, 2.7240974430366087 ], [ 0.8052011096745613, 13.638581509599378, 0.31837021196339144 ], [ -0.8052011096745613, 15.785228489599378, 3.3786805269633917 ], [ -0.8052011096745616, 6.203593990400621, 5.7844077580366084 ], [ -2.502298574934189, 11.243580882695138, 4.027072909087679 ], [ -2.502298574934189, 10.74524159730486, 5.136015375912321 ], [ 2.502298574934189, 8.59859461730486, 2.075705060912322 ], [ 2.502298574934189, 9.096933902695138, 0.9667625940876786 ], [ -1.8602747010668124, 11.151914501231076, 1.8340548399019743 ], [ -1.8602747010668128, 6.543614018768923, 1.2084128150980258 ], [ 1.8602747010668128, 8.690260998768924, 4.268723130098025 ], [ 1.8602747010668124, 13.298561481231076, 4.894365154901974 ], [ 0.2046626990001439, 5.143120284240209, 2.5094105688694963 ], [ 0.2046626990001439, 12.552408235759792, 0.5330570861305036 ], [ -0.2046626990001439, 14.699055215759792, 3.593367401130504 ], [ -0.2046626990001439, 7.289767264240209, 5.569720883869497 ], [ -0.8703704071887437, 14.414823479422942, 5.892875710438842 ], [ -0.8703704071887438, 7.573999000577056, 3.270212574561159 ], [ 0.8703704071887438, 5.4273520205770565, 0.20990225956115893 ], [ 0.8703704071887437, 12.268176499422943, 2.832565395438841 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.57474484, 0, 0 ], [ 0, 1.22604513, -0.45324313 ], [ 0, -0.45324311, 1.25084713 ] ]
-146.975965
-158.495965
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00934451, -0.00782108, -0.04434574 ], [ 0.00934451, 0.00782108, 0.04434574 ], [ -0.00934451, 0.00782108, 0.04434574 ], [ -0.00934451, -0.00782108, -0.04434574 ], [ -0.00151359, -0.00678937, -0.00564479 ], [ -0.00151359, 0.00678937, 0.00564479 ], [ 0.00151359, 0.00678937, 0.00564479 ], [ 0.00151359, -0.00678937, -0.00564479 ], [ -0.00917535, 0.00059417, 0.01431993 ], [ -0.00917535, -0.00059417, -0.01431993 ], [ 0.00917535, -0.00059417, -0.01431993 ], [ 0.00917535, 0.00059417, 0.01431993 ], [ -0.01466955, 0.00047213, -0.00469238 ], [ -0.01466955, -0.00047213, 0.00469238 ], [ 0.01466955, -0.00047213, 0.00469238 ], [ 0.01466955, 0.00047213, -0.00469238 ], [ 0.00015768, 0.00038001, 0.00977432 ], [ 0.00015768, -0.00038001, -0.00977432 ], [ -0.00015768, -0.00038001, -0.00977432 ], [ -0.00015768, 0.00038001, 0.00977432 ] ]
pbe
true
15
agm005266151-pbe-391
391
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.32074626, 7.77544353, -0.00846675 ], [ -3.32074626, 7.77544353, -0.00846675 ], [ 0, 4.29420617, 6.12112102 ] ]
agm005266151
[ [ 1.66037313, 3.887721765, -0.004233375 ], [ -1.66037313, 6.03482485, 3.056327135 ], [ 0.8047572531573354, 4.057719087194459, 2.724570117312781 ], [ 0.8047572531573355, 13.64027105780554, 0.3190568926872187 ], [ -0.8047572531573355, 15.787374142805541, 3.3796174026872188 ], [ -0.8047572531573354, 6.20482217219446, 5.785130627312782 ], [ -2.5020200220402735, 11.245262525716047, 4.027782204520712 ], [ -2.5020200220402735, 10.746933789283952, 5.136965825479289 ], [ 2.5020200220402735, 8.599830704283953, 2.076405315479288 ], [ 2.5020200220402735, 9.098159440716048, 0.9672216945207119 ], [ -1.8598770234306676, 11.153439149748248, 1.8348347297554926 ], [ -1.8598770234306676, 6.544550995251754, 1.208792280244508 ], [ 1.8598770234306676, 8.691654080251753, 4.269352790244508 ], [ 1.8598770234306676, 13.300542234748248, 4.8953952397554925 ], [ 0.20463139131580865, 5.143813489382661, 2.5098585924407852 ], [ 0.2046313913158091, 12.554176655617338, 0.5337684175592151 ], [ -0.2046313913158091, 14.70127974061734, 3.5943289275592156 ], [ -0.20463139131580865, 7.290916574382662, 5.570419102440785 ], [ -0.8696138849673676, 14.417357218242302, 5.894253718339092 ], [ -0.8696138849673679, 7.5748390967576995, 3.2704943116609084 ], [ 0.8696138849673679, 5.427736011757699, 0.20993380166090791 ], [ 0.8696138849673676, 12.270254133242302, 2.8336932083390924 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.518076, 0, 0 ], [ 0, 1.35874372, -0.55289093 ], [ 0, -0.5528909, 0.96524489 ] ]
-146.975982
-158.495982
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.02181462, -0.02169212, -0.05388346 ], [ 0.02181462, 0.02169212, 0.05388346 ], [ -0.02181462, 0.02169212, 0.05388346 ], [ -0.02181462, -0.02169212, -0.05388346 ], [ -0.0016494, -0.01710112, 0.01722375 ], [ -0.0016494, 0.01710112, -0.01722375 ], [ 0.0016494, 0.01710112, -0.01722375 ], [ 0.0016494, -0.01710112, 0.01722375 ], [ -0.01492514, 0.00578386, 0.02038516 ], [ -0.01492514, -0.00578386, -0.02038516 ], [ 0.01492514, -0.00578386, -0.02038516 ], [ 0.01492514, 0.00578386, 0.02038516 ], [ -0.02045404, 0.01064481, -0.00716039 ], [ -0.02045404, -0.01064481, 0.00716039 ], [ 0.02045404, -0.01064481, 0.00716039 ], [ 0.02045404, 0.01064481, -0.00716039 ], [ -0.00043608, 0.00155809, 0.01019269 ], [ -0.00043608, -0.00155809, -0.01019269 ], [ 0.00043608, -0.00155809, -0.01019269 ], [ 0.00043608, 0.00155809, 0.01019269 ] ]
pbe
true
15
agm005266151-pbe-392
392
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.31901218, 7.77862837, -0.0078541 ], [ -3.31901218, 7.77862837, -0.0078541 ], [ 0, 4.29644894, 6.12255131 ] ]
agm005266151
[ [ 1.65950609, 3.889314185, -0.00392705 ], [ -1.65950609, 6.0375386550000005, 3.057348605 ], [ 0.8039598728850789, 4.059573036403146, 2.725102865977994 ], [ 0.8039598728850788, 13.645908173596853, 0.3204645890220064 ], [ -0.8039598728850788, 15.794132643596853, 3.3817402440220063 ], [ -0.8039598728850789, 6.207797506403146, 5.786378520977994 ], [ -2.5013027681173226, 11.250002343672104, 4.029314692441133 ], [ -2.501302768117322, 10.751927806327895, 5.138804072558867 ], [ 2.501302768117322, 8.603703336327895, 2.0775284175588675 ], [ 2.5013027681173226, 9.101777873672106, 0.9680390374411332 ], [ -1.8590617637027438, 11.158164071933639, 1.8363667494338787 ], [ -1.8590617637027438, 6.547317138066361, 1.2092007055661214 ], [ 1.8590617637027438, 8.69554160806636, 4.270476360566121 ], [ 1.8590617637027438, 13.30638854193364, 4.897642404433879 ], [ 0.20434447723653482, 5.145968072374379, 2.510738772978847 ], [ 0.20434447723653504, 12.55951313762562, 0.5348286820211534 ], [ -0.20434447723653504, 14.70773760762562, 3.596104337021153 ], [ -0.20434447723653482, 7.29419254237438, 5.572014427978847 ], [ -0.8679047581078825, 14.424472617835363, 5.8971986579498745 ], [ -0.8679047581078819, 7.5774575321646385, 3.270920107050127 ], [ 0.8679047581078819, 5.429233062164638, 0.2096444520501264 ], [ 0.8679047581078825, 12.276248147835362, 2.8359230029498734 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.47591406, 0, 0 ], [ 0, 1.12451008, -0.28392933 ], [ 0, -0.28392932, 0.4331765 ] ]
-146.976241
-158.496241
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.02281569, -0.03030981, -0.03397803 ], [ 0.02281569, 0.03030981, 0.03397803 ], [ -0.02281569, 0.03030981, 0.03397803 ], [ -0.02281569, -0.03030981, -0.03397803 ], [ -0.00216754, -0.01738587, 0.02187427 ], [ -0.00216754, 0.01738587, -0.02187427 ], [ 0.00216754, 0.01738587, -0.02187427 ], [ 0.00216754, -0.01738587, 0.02187427 ], [ -0.01466371, 0.00793311, 0.01124036 ], [ -0.01466371, -0.00793311, -0.01124036 ], [ 0.01466371, -0.00793311, -0.01124036 ], [ 0.01466371, 0.00793311, 0.01124036 ], [ -0.02044598, 0.01234328, -0.01050455 ], [ -0.02044598, -0.01234328, 0.01050455 ], [ 0.02044598, -0.01234328, 0.01050455 ], [ 0.02044598, 0.01234328, -0.01050455 ], [ -0.00290129, 0.00690846, 0.00994387 ], [ -0.00290129, -0.00690846, -0.00994387 ], [ 0.00290129, -0.00690846, -0.00994387 ], [ 0.00290129, 0.00690846, 0.00994387 ] ]
pbe
true
15
agm005266151-pbe-393
393
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.31380995, 7.78818287, -0.00601614 ], [ -3.31380995, 7.78818287, -0.00601614 ], [ 0, 4.30317727, 6.12684215 ] ]
agm005266151
[ [ 1.656904975, 3.894091435, -0.00300807 ], [ -1.656904975, 6.0456800699999995, 3.060413005 ], [ 0.8015695025235205, 4.065134512171973, 2.7267004942396844 ], [ 0.8015695025235208, 13.662819862828027, 0.3246883007603157 ], [ -0.8015695025235208, 15.814408497828028, 3.388109375760316 ], [ -0.8015695025235205, 6.216723147171972, 5.790121569239684 ], [ -2.4991482139879198, 11.264221439548724, 4.033911936131785 ], [ -2.49914821398792, 10.766910205451277, 5.144319008868214 ], [ 2.49914821398792, 8.615321570451277, 2.0808979338682145 ], [ 2.4991482139879198, 9.112632804548724, 0.9704908611317854 ], [ -1.8566152774133964, 11.172339048871178, 1.8409633311475275 ], [ -1.8566152774133964, 6.555615326128823, 1.2104254638524725 ], [ 1.8566152774133964, 8.707203961128823, 4.273846538852472 ], [ 1.8566152774133964, 13.32392768387118, 4.9043844061475275 ], [ 0.2034845993940485, 5.152431259587683, 2.5133792201071667 ], [ 0.20348459939404817, 12.575523115412317, 0.5380095748928329 ], [ -0.20348459939404817, 14.727111750412316, 3.601430649892833 ], [ -0.2034845993940485, 7.304019894587683, 5.576800295107168 ], [ -0.862783227201005, 14.445821777669892, 5.90603523011295 ], [ -0.862783227201005, 7.585309867330109, 3.2721957148870495 ], [ 0.862783227201005, 5.433721232330108, 0.20877463988704958 ], [ 0.862783227201005, 12.294233142669892, 2.8426141551129502 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.3595745, 0, 0 ], [ 0, 0.33031016, 0.50239376 ], [ 0, 0.50239375, -1.24165671 ] ]
-146.976622
-158.496622
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.02540336, -0.05584717, 0.02564048 ], [ 0.02540336, 0.05584717, -0.02564048 ], [ -0.02540336, 0.05584717, -0.02564048 ], [ -0.02540336, -0.05584717, 0.02564048 ], [ -0.0043625, -0.01827419, 0.03565684 ], [ -0.0043625, 0.01827419, -0.03565684 ], [ 0.0043625, 0.01827419, -0.03565684 ], [ 0.0043625, -0.01827419, 0.03565684 ], [ -0.01461327, 0.01464822, -0.01374894 ], [ -0.01461327, -0.01464822, 0.01374894 ], [ 0.01461327, -0.01464822, 0.01374894 ], [ 0.01461327, 0.01464822, -0.01374894 ], [ -0.01943407, 0.01666816, -0.02082594 ], [ -0.01943407, -0.01666816, 0.02082594 ], [ 0.01943407, -0.01666816, 0.02082594 ], [ 0.01943407, 0.01666816, -0.02082594 ], [ -0.00912588, 0.02196531, 0.00936488 ], [ -0.00912588, -0.02196531, -0.00936488 ], [ 0.00912588, -0.02196531, -0.00936488 ], [ 0.00912588, 0.02196531, 0.00936488 ] ]
pbe
true
15
agm005266151-pbe-394
394
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.31139574, 7.79267679, -0.00475497 ], [ -3.31139574, 7.79267679, -0.00475497 ], [ 0, 4.30665339, 6.12809625 ] ]
agm005266151
[ [ 1.65569787, 3.896338395, -0.002377485 ], [ -1.65569787, 6.0496650899999995, 3.06167064 ], [ 0.8008164883323396, 4.067171455119784, 2.727577476653622 ], [ 0.8008164883323396, 13.671508819880215, 0.32696070834637764 ], [ -0.8008164883323396, 15.824835514880215, 3.3910088333463775 ], [ -0.8008164883323396, 6.220498150119784, 5.791625601653622 ], [ -2.4981587029562813, 11.27089684058122, 4.036465865840968 ], [ -2.4981587029562813, 10.77443682441878, 5.146168569159031 ], [ 2.4981587029562813, 8.62111012941878, 2.0821204441590324 ], [ 2.4981587029562813, 9.11757014558122, 0.9724177408409675 ], [ -1.8556559057086668, 11.179288057813405, 1.8431897401764301 ], [ -1.8556559057086668, 6.559392217186595, 1.2113484448235696 ], [ 1.8556559057086668, 8.712718912186595, 4.275396569823569 ], [ 1.8556559057086668, 13.332614752813406, 4.9072378651764295 ], [ 0.2028493808990478, 5.155828182346579, 2.514209009980137 ], [ 0.20284938089904792, 12.582852092653422, 0.5403291750198627 ], [ -0.20284938089904792, 14.736178787653422, 3.6043773000198627 ], [ -0.2028493808990478, 7.309154877346579, 5.578257134980137 ], [ -0.8606214543852486, 14.456377004234895, 5.910026999657333 ], [ -0.8606214543852486, 7.588956660765103, 3.272607435342666 ], [ 0.8606214543852486, 5.435629965765103, 0.2085593103426666 ], [ 0.8606214543852486, 12.303050309234896, 2.8459788746573333 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.53653609, 0, 0 ], [ 0, -0.5644303, 0.54387944 ], [ 0, 0.54387941, -0.34743209 ] ]
-146.976899
-158.496899
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00829858, -0.00646162, 0.03392077 ], [ -0.00829858, 0.00646162, -0.03392077 ], [ 0.00829858, 0.00646162, -0.03392077 ], [ 0.00829858, -0.00646162, 0.03392077 ], [ -0.00462537, 0.02729021, -0.06071128 ], [ -0.00462537, -0.02729021, 0.06071128 ], [ 0.00462537, -0.02729021, 0.06071128 ], [ 0.00462537, 0.02729021, -0.06071128 ], [ -0.00855509, 0.00659155, -0.01913361 ], [ -0.00855509, -0.00659155, 0.01913361 ], [ 0.00855509, -0.00659155, 0.01913361 ], [ 0.00855509, 0.00659155, -0.01913361 ], [ 0.00893171, -0.03121077, -0.01060961 ], [ 0.00893171, 0.03121077, 0.01060961 ], [ -0.00893171, 0.03121077, 0.01060961 ], [ -0.00893171, -0.03121077, -0.01060961 ], [ -0.00898519, 0.0228345, 0.00830026 ], [ -0.00898519, -0.0228345, -0.00830026 ], [ 0.00898519, -0.0228345, -0.00830026 ], [ 0.00898519, 0.0228345, 0.00830026 ] ]
pbe
true
15
agm005266151-pbe-395
395
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.31127938, 7.79289338, -0.00469418 ], [ -3.31127938, 7.79289338, -0.00469418 ], [ 0, 4.30682093, 6.12815669 ] ]
agm005266151
[ [ 1.65563969, 3.89644669, -0.00234709 ], [ -1.65563969, 6.049857155, 3.0617312549999998 ], [ 0.8007802355980642, 4.0672696225057985, 2.7276197086379126 ], [ 0.8007802355980642, 13.6719276024942, 0.32707027636208746 ], [ -0.8007802355980642, 15.8253380674942, 3.3911486213620874 ], [ -0.8007802355980642, 6.220680087505798, 5.791698053637912 ], [ -2.498111019098274, 11.271218585898673, 4.036588918666338 ], [ -2.498111019098274, 10.774799569101328, 5.146257756333662 ], [ 2.498111019098274, 8.621389104101327, 2.082179411333662 ], [ 2.498111019098274, 9.117808120898673, 0.9725105736663383 ], [ -1.8556096729618592, 11.179622934963863, 1.8432969984596528 ], [ -1.8556096729618594, 6.559574290036136, 1.2113929865403472 ], [ 1.8556096729618594, 8.712984755036135, 4.275471331540348 ], [ 1.8556096729618592, 13.333033399963861, 4.907375343459653 ], [ 0.20281874283806067, 5.155991931159, 2.514248971650015 ], [ 0.20281874283806056, 12.583205293840997, 0.540441013349985 ], [ -0.20281874283806056, 14.736615758840998, 3.604519358349985 ], [ -0.20281874283806067, 7.309402396158999, 5.5783273166500145 ], [ -0.860517238801779, 14.456885631595174, 5.910219357901511 ], [ -0.8605172388017791, 7.589132523404825, 3.27262731709849 ], [ 0.8605172388017791, 5.435722058404824, 0.2085489720984901 ], [ 0.860517238801779, 12.303475166595174, 2.84614101290151 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.54990111, 0, 0 ], [ 0, -0.6254442, 0.54391719 ], [ 0, 0.54391707, -0.32448575 ] ]
-146.9769
-158.4969
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00985474, -0.00433085, 0.03443872 ], [ -0.00985474, 0.00433085, -0.03443872 ], [ 0.00985474, 0.00433085, -0.03443872 ], [ 0.00985474, -0.00433085, 0.03443872 ], [ -0.00481435, 0.02927366, -0.06508604 ], [ -0.00481435, -0.02927366, 0.06508604 ], [ 0.00481435, -0.02927366, 0.06508604 ], [ 0.00481435, 0.02927366, -0.06508604 ], [ -0.00835889, 0.00621942, -0.01916343 ], [ -0.00835889, -0.00621942, 0.01916343 ], [ 0.00835889, -0.00621942, 0.01916343 ], [ 0.00835889, 0.00621942, -0.01916343 ], [ 0.01018905, -0.03350761, -0.01013638 ], [ 0.01018905, 0.03350761, 0.01013638 ], [ -0.01018905, 0.03350761, 0.01013638 ], [ -0.01018905, -0.03350761, -0.01013638 ], [ -0.00879869, 0.02315131, 0.00851412 ], [ -0.00879869, -0.02315131, -0.00851412 ], [ 0.00879869, -0.02315131, -0.00851412 ], [ 0.00879869, 0.02315131, 0.00851412 ] ]
pbe
true
15
agm005266151-pbe-396
396
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.30914073, 7.79617274, -0.0032942 ], [ -3.30914073, 7.79617274, -0.0032942 ], [ 0, 4.30973486, 6.12921841 ] ]
agm005266151
[ [ 1.654570365, 3.89808637, -0.0016471 ], [ -1.654570365, 6.0529538, 3.062962105 ], [ 0.8000302390711301, 4.068813404523173, 2.728782464291547 ], [ 0.8000302390711305, 13.678399505476827, 0.3292383407084534 ], [ -0.8000302390711305, 15.833266935476827, 3.3938475457084536 ], [ -0.8000302390711301, 6.223680834523172, 5.793391669291546 ], [ -2.497226704739294, 11.27657318772156, 4.038481583871309 ], [ -2.497226704739294, 10.780374582278439, 5.148757631128691 ], [ 2.497226704739294, 8.62550715227844, 2.084148426128692 ], [ 2.497226704739294, 9.12170575772156, 0.973872378871308 ], [ -1.8548139823217573, 11.184885760216208, 1.845414529915072 ], [ -1.8548139823217573, 6.562327149783792, 1.2126062750849278 ], [ 1.8548139823217573, 8.717194579783794, 4.277215480084928 ], [ 1.8548139823217573, 13.339753190216209, 4.910023734915072 ], [ 0.20238443282562324, 5.158307877400542, 2.5150050369834784 ], [ 0.20238443282562368, 12.588905032599458, 0.5430157680165211 ], [ -0.20238443282562368, 14.743772462599457, 3.607624973016521 ], [ -0.20238443282562324, 7.313175307400542, 5.579614241983479 ], [ -0.8587848931088702, 14.465289835380625, 5.914091864312031 ], [ -0.8587848931088699, 7.5916579346193735, 3.27314735068797 ], [ 0.8587848931088699, 5.436790504619374, 0.20853814568797002 ], [ 0.8587848931088702, 12.310422405380626, 2.84948265931203 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.47245493, 0, 0 ], [ 0, -0.75532728, 0.68006237 ], [ 0, 0.68006239, -0.12359833 ] ]
-146.977155
-158.497155
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02570142, 0.03172953, 0.00663145 ], [ -0.02570142, -0.03172953, -0.00663145 ], [ 0.02570142, -0.03172953, -0.00663145 ], [ 0.02570142, 0.03172953, 0.00663145 ], [ -0.00367257, 0.00312623, -0.00516392 ], [ -0.00367257, -0.00312623, 0.00516392 ], [ 0.00367257, -0.00312623, 0.00516392 ], [ 0.00367257, 0.00312623, -0.00516392 ], [ -0.00373916, -0.00289319, -0.01647971 ], [ -0.00373916, 0.00289319, 0.01647971 ], [ 0.00373916, 0.00289319, 0.01647971 ], [ 0.00373916, -0.00289319, -0.01647971 ], [ 0.02164995, -0.0528786, -0.00249308 ], [ 0.02164995, 0.0528786, 0.00249308 ], [ -0.02164995, 0.0528786, 0.00249308 ], [ -0.02164995, -0.0528786, -0.00249308 ], [ -0.00588465, 0.01771374, 0.00727474 ], [ -0.00588465, -0.01771374, -0.00727474 ], [ 0.00588465, -0.01771374, -0.00727474 ], [ 0.00588465, 0.01771374, 0.00727474 ] ]
pbe
true
15
agm005266151-pbe-397
397
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.30778362, 7.7982537, -0.00240581 ], [ -3.30778362, 7.7982537, -0.00240581 ], [ 0, 4.31158394, 6.12989213 ] ]
agm005266151
[ [ 1.65389181, 3.89912685, -0.001202905 ], [ -1.65389181, 6.05491882, 3.06374316 ], [ 0.7995543803876334, 4.069792863082744, 2.729520276874683 ], [ 0.7995543803876335, 13.682506506917257, 0.3306141681253172 ], [ -0.7995543803876335, 15.838298476917258, 3.395560233125317 ], [ -0.7995543803876334, 6.225584833082744, 5.794466341874683 ], [ -2.4966653603881914, 11.279971021137367, 4.039682549521333 ], [ -2.4966653603881914, 10.783912288862634, 5.150344025478667 ], [ 2.4966653603881914, 8.628120318862635, 2.085397960478667 ], [ 2.4966653603881914, 9.124179051137366, 0.9747364845213332 ], [ -1.8543090302666794, 11.18822539041053, 1.8467581746409862 ], [ -1.8543090302666794, 6.5640739795894705, 1.2133762703590139 ], [ 1.8543090302666794, 8.71986594958947, 4.278322335359013 ], [ 1.8543090302666794, 13.344017360410529, 4.9117042396409865 ], [ 0.20210892004345626, 5.15977731464627, 2.5154847330620527 ], [ 0.20210892004345604, 12.592522055353731, 0.5446497119379473 ], [ -0.20210892004345604, 14.74831402535373, 3.609595776937948 ], [ -0.20210892004345626, 7.315569284646269, 5.580430798062053 ], [ -0.8576858658930566, 14.470623068592612, 5.916549292300915 ], [ -0.8576858658930564, 7.593260241407389, 3.2734772826990852 ], [ 0.8576858658930564, 5.437468271407388, 0.20853121769908503 ], [ 0.8576858658930566, 12.314831098592613, 2.851603227300915 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.42997225, 0, 0 ], [ 0, -0.86754017, 0.75806524 ], [ 0, 0.75806525, -0.02154541 ] ]
-146.977203
-158.497203
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.03564322, 0.0542466, -0.01101665 ], [ -0.03564322, -0.0542466, 0.01101665 ], [ 0.03564322, -0.0542466, 0.01101665 ], [ 0.03564322, 0.0542466, -0.01101665 ], [ -0.00325093, -0.01350567, 0.03275839 ], [ -0.00325093, 0.01350567, -0.03275839 ], [ 0.00325093, 0.01350567, -0.03275839 ], [ 0.00325093, -0.01350567, 0.03275839 ], [ -0.0011029, -0.00862689, -0.01436822 ], [ -0.0011029, 0.00862689, 0.01436822 ], [ 0.0011029, 0.00862689, 0.01436822 ], [ 0.0011029, -0.00862689, -0.01436822 ], [ 0.02904865, -0.06531626, 0.00206813 ], [ 0.02904865, 0.06531626, -0.00206813 ], [ -0.02904865, 0.06531626, -0.00206813 ], [ -0.02904865, -0.06531626, 0.00206813 ], [ -0.00373315, 0.01439727, 0.0066098 ], [ -0.00373315, -0.01439727, -0.0066098 ], [ 0.00373315, -0.01439727, -0.0066098 ], [ 0.00373315, 0.01439727, 0.0066098 ] ]
pbe
true
15
agm005266151-pbe-398
398
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.30579828, 7.80072332, -0.00078104 ], [ -3.30579828, 7.80072332, -0.00078104 ], [ 0, 4.31422688, 6.13103711 ] ]
agm005266151
[ [ 1.65289914, 3.90036166, -0.00039052 ], [ -1.65289914, 6.0574751, 3.0651280350000003 ], [ 0.7986108806984125, 4.071459369166549, 2.7306678062741074 ], [ 0.7986108806984125, 13.687100710833453, 0.33328866872589274 ], [ -0.7986108806984125, 15.844214150833453, 3.398807223725893 ], [ -0.7986108806984125, 6.228572809166549, 5.796186361274108 ], [ -2.4958364780954483, 11.284186253088155, 4.042146545819507 ], [ -2.4958364780954483, 10.788600706911845, 5.152847039180494 ], [ 2.4958364780954483, 8.631487266911845, 2.087328484180494 ], [ 2.4958364780954483, 9.127072813088155, 0.9766279908195061 ], [ -1.8535610294800344, 11.192291787831833, 1.8490795433982472 ], [ -1.8535610294800342, 6.566268292168168, 1.214876931601753 ], [ 1.8535610294800342, 8.723381732168168, 4.280395486601753 ], [ 1.8535610294800344, 13.349405227831832, 4.9145980983982485 ], [ 0.20192853914899922, 5.161192613901536, 2.5164202676240297 ], [ 0.20192853914899933, 12.597367466098465, 0.5475362073759702 ], [ -0.20192853914899933, 14.754480906098465, 3.613054762375971 ], [ -0.20192853914899922, 7.318306053901535, 5.58193882262403 ], [ -0.8561553741701318, 14.477657364574782, 5.920734011185268 ], [ -0.8561553741701315, 7.595129595425215, 3.2742595738147315 ], [ 0.8561553741701315, 5.438016155425215, 0.2087410188147315 ], [ 0.8561553741701318, 12.320543924574782, 2.855215456185269 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.01281483, 0, 0 ], [ 0, 0.20678178, 0.46789486 ], [ 0, 0.46789474, 0.32480475 ] ]
-146.977493
-158.497493
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02011311, 0.03482469, -0.02443089 ], [ -0.02011311, -0.03482469, 0.02443089 ], [ 0.02011311, -0.03482469, 0.02443089 ], [ 0.02011311, 0.03482469, -0.02443089 ], [ -0.00131008, -0.01283365, 0.02879383 ], [ -0.00131008, 0.01283365, -0.02879383 ], [ 0.00131008, 0.01283365, -0.02879383 ], [ 0.00131008, -0.01283365, 0.02879383 ], [ -0.00091694, -0.01285129, -0.00713407 ], [ -0.00091694, 0.01285129, 0.00713407 ], [ 0.00091694, 0.01285129, 0.00713407 ], [ 0.00091694, -0.01285129, -0.00713407 ], [ 0.01448499, -0.03789982, -0.00049601 ], [ 0.01448499, 0.03789982, 0.00049601 ], [ -0.01448499, 0.03789982, 0.00049601 ], [ -0.01448499, -0.03789982, -0.00049601 ], [ 0.00070557, 0.00688129, 0.00620533 ], [ 0.00070557, -0.00688129, -0.00620533 ], [ -0.00070557, -0.00688129, -0.00620533 ], [ -0.00070557, 0.00688129, 0.00620533 ] ]
pbe
true
15
agm005266151-pbe-399
399
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.57377268, 6.83881681, 0.03208205 ], [ -3.57377268, 6.83881681, 0.03208205 ], [ 0, 3.81645147, 6.22002452 ] ]
agm005266151
[ [ 1.78688634, 3.419408405, 0.016041025 ], [ -1.78688634, 5.32763414, 3.126053285 ], [ 0.7785458780098248, 3.625492261778967, 2.7591951751745327 ], [ 0.7785458780098247, 11.960367093221032, 0.4149811848254672 ], [ -0.7785458780098247, 13.868592828221033, 3.524993444825467 ], [ -0.7785458780098248, 5.533717996778967, 5.869207435174532 ], [ -2.735727418018123, 9.9492083646069, 4.140391076306203 ], [ -2.735727418018123, 9.453102460393099, 5.2538098036937955 ], [ 2.735727418018123, 7.544876725393099, 2.1437975436937964 ], [ 2.735727418018123, 8.0409826296069, 1.030378816306204 ], [ -2.0334321971878606, 9.849106283353352, 1.9647310668559324 ], [ -2.0334321971878606, 5.736753071646648, 1.209445293144068 ], [ 2.0334321971878606, 7.644978806646648, 4.319457553144068 ], [ 2.0334321971878606, 11.757332018353353, 5.074743326855932 ], [ 0.02458165931347811, 4.599404877598392, 2.45855257136061 ], [ 0.024581659313478, 10.986454477401606, 0.7156237886393899 ], [ -0.024581659313478, 12.894680212401607, 3.8256360486393897 ], [ -0.02458165931347811, 6.507630612598392, 5.568564831360611 ], [ -1.0857287224892354, 12.458352765261086, 6.160702687940579 ], [ -1.0857287224892351, 6.943958059738915, 3.233498192059421 ], [ 1.0857287224892351, 5.035732324738915, 0.1234859320594208 ], [ 1.0857287224892354, 10.550127030261086, 3.0506904279405793 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 1.13518866, 0, 0 ], [ 0, -9.97311172, 6.23315195 ], [ 0, 6.23315192, -19.81804817 ] ]
-146.652638
-158.172638
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.13271387, 0.08027177, 0.08120056 ], [ -0.13271387, -0.08027177, -0.08120056 ], [ 0.13271387, -0.08027177, -0.08120056 ], [ 0.13271387, 0.08027177, 0.08120056 ], [ -0.02240805, -0.09053902, -0.00644048 ], [ -0.02240805, 0.09053902, 0.00644048 ], [ 0.02240805, 0.09053902, 0.00644048 ], [ 0.02240805, -0.09053902, -0.00644048 ], [ 0.00941881, -0.06204963, -0.1196209 ], [ 0.00941881, 0.06204963, 0.1196209 ], [ -0.00941881, 0.06204963, 0.1196209 ], [ -0.00941881, -0.06204963, -0.1196209 ], [ 0.25250683, -0.18807839, 0.17669748 ], [ 0.25250683, 0.18807839, -0.17669748 ], [ -0.25250683, 0.18807839, -0.17669748 ], [ -0.25250683, -0.18807839, 0.17669748 ], [ -0.17025482, 0.44890102, -0.08252954 ], [ -0.17025482, -0.44890102, 0.08252954 ], [ 0.17025482, -0.44890102, 0.08252954 ], [ 0.17025482, 0.44890102, -0.08252954 ] ]
pbe
true
15
agm005266151-pbe-4
4
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.53638328, 7.159072, -0.02579723 ], [ -3.53638328, 7.159072, -0.02579723 ], [ 0, 3.94566968, 6.09537665 ] ]
agm005266151
[ [ 1.76819164, 3.579536, -0.012898615 ], [ -1.76819164, 5.55237084, 3.03478971 ], [ 0.7896181225660153, 3.748647543338537, 2.6830288476429067 ], [ 0.789618122566015, 12.542331296661464, 0.31306501735709347 ], [ -0.789618122566015, 14.515166136661463, 3.3607533423570937 ], [ -0.7896181225660153, 5.721482383338537, 5.730717172642907 ], [ -2.718429851039152, 10.354216861474267, 3.9860053638380473 ], [ -2.718429851039152, 9.882431658525734, 5.105465151161954 ], [ 2.718429851039152, 7.909596818525734, 2.0577768261619536 ], [ 2.718429851039152, 8.381382021474266, 0.9383170388380467 ], [ -2.0210609739832295, 10.253003820706502, 1.815489556456014 ], [ -2.0210609739832295, 6.0379750192935, 1.1806043085439863 ], [ 2.0210609739832295, 8.0108098592935, 4.228292633543986 ], [ 2.0210609739832295, 12.225838660706502, 4.863177881456014 ], [ 0.11599284112650798, 4.779948613866045, 2.4169382223772997 ], [ 0.11599284112650832, 11.511030226133956, 0.5791556426227007 ], [ -0.11599284112650832, 13.483865066133955, 3.6268439676227007 ], [ -0.11599284112650798, 6.752783453866045, 5.4646265473773 ], [ -1.0815917219445008, 13.093061948073338, 5.85250314658467 ], [ -1.0815917219445008, 7.1435865719266625, 3.23896736841533 ], [ 1.0815917219445008, 5.1707517319266625, 0.19127904341533022 ], [ 1.0815917219445008, 11.120227108073339, 2.80481482158467 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ -0.53603479, 0, 0 ], [ 0, -2.08703718, 0.61154032 ], [ 0, 0.6115403, -0.80917138 ] ]
-146.824196
-158.344196
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.05433832, -0.01623592, 0.03088322 ], [ 0.05433832, 0.01623592, -0.03088322 ], [ -0.05433832, 0.01623592, -0.03088322 ], [ -0.05433832, -0.01623592, 0.03088322 ], [ -0.01676368, 0.07902749, -0.14295667 ], [ -0.01676368, -0.07902749, 0.14295667 ], [ 0.01676368, -0.07902749, 0.14295667 ], [ 0.01676368, 0.07902749, -0.14295667 ], [ 0.01892306, 0.01099169, -0.04200088 ], [ 0.01892306, -0.01099169, 0.04200088 ], [ -0.01892306, -0.01099169, 0.04200088 ], [ -0.01892306, 0.01099169, -0.04200088 ], [ 0.01611146, -0.01517589, 0.07712301 ], [ 0.01611146, 0.01517589, -0.07712301 ], [ -0.01611146, 0.01517589, -0.07712301 ], [ -0.01611146, -0.01517589, 0.07712301 ], [ 0.02869216, 0.04857384, 0.00205103 ], [ 0.02869216, -0.04857384, -0.00205103 ], [ -0.02869216, -0.04857384, -0.00205103 ], [ -0.02869216, 0.04857384, 0.00205103 ] ]
pbe
true
15
agm005266151-pbe-40
40
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.30307484, 7.80411108, 0.00144779 ], [ -3.30307484, 7.80411108, 0.00144779 ], [ 0, 4.31785242, 6.13260777 ] ]
agm005266151
[ [ 1.65153742, 3.90205554, 0.000723895 ], [ -1.65153742, 6.06098175, 3.06702778 ], [ 0.7973171463736857, 4.073745296318355, 2.7322418421921144 ], [ 0.7973171463736857, 13.693403073681646, 0.33695762280788527 ], [ -0.7973171463736857, 15.852329283681645, 3.403261507807885 ], [ -0.7973171463736857, 6.232671506318356, 5.798545727192114 ], [ -2.494698635723762, 11.289968484041811, 4.045526548195694 ], [ -2.4946986357237617, 10.795032305958191, 5.1562806868043065 ], [ 2.4946986357237617, 8.63610609595819, 2.0899768018043066 ], [ 2.494698635723762, 9.13104227404181, 0.9792226631956937 ], [ -1.8525345116570084, 11.197870067550504, 1.8522639802841567 ], [ -1.8525345116570087, 6.569278302449498, 1.2169354847158436 ], [ 1.8525345116570087, 8.728204512449498, 4.283239369715844 ], [ 1.8525345116570084, 13.356796277550503, 4.918567865284157 ], [ 0.20168115845637247, 5.1631334530153215, 2.517703225390128 ], [ 0.2016811584563727, 12.604014916984678, 0.551496239609872 ], [ -0.2016811584563727, 14.762941126984678, 3.617800124609872 ], [ -0.20168115845637247, 7.322059663015322, 5.584007110390128 ], [ -0.8540569365754762, 14.487307874532748, 5.926475033860927 ], [ -0.8540569365754763, 7.597692915467253, 3.2753322011390718 ], [ 0.8540569365754763, 5.438766705467252, 0.2090283161390721 ], [ 0.8540569365754762, 12.328381664532747, 2.860171148860928 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.52029569, 0, 0 ], [ 0, 1.61143773, 0.06076452 ], [ 0, 0.06076455, 0.75458999 ] ]
-146.977675
-158.497675
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00078376, 0.00843129, -0.04286713 ], [ 0.00078376, -0.00843129, 0.04286713 ], [ -0.00078376, -0.00843129, 0.04286713 ], [ -0.00078376, 0.00843129, -0.04286713 ], [ 0.00091381, -0.01186118, 0.02307696 ], [ 0.00091381, 0.01186118, -0.02307696 ], [ -0.00091381, 0.01186118, -0.02307696 ], [ -0.00091381, -0.01186118, 0.02307696 ], [ -0.00115855, -0.01856196, 0.00331984 ], [ -0.00115855, 0.01856196, -0.00331984 ], [ 0.00115855, 0.01856196, -0.00331984 ], [ 0.00115855, -0.01856196, 0.00331984 ], [ -0.00501139, -0.00082631, -0.0042985 ], [ -0.00501139, 0.00082631, 0.0042985 ], [ 0.00501139, 0.00082631, 0.0042985 ], [ 0.00501139, -0.00082631, -0.0042985 ], [ 0.0072551, -0.00399541, 0.00518245 ], [ 0.0072551, 0.00399541, -0.00518245 ], [ -0.0072551, 0.00399541, -0.00518245 ], [ -0.0072551, -0.00399541, 0.00518245 ] ]
pbe
true
15
agm005266151-pbe-400
400
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.30248194, 7.8048486, 0.00193301 ], [ -3.30248194, 7.8048486, 0.00193301 ], [ 0, 4.31864171, 6.13294971 ] ]
agm005266151
[ [ 1.65124097, 3.9024243, 0.000966505 ], [ -1.65124097, 6.061745155, 3.06744136 ], [ 0.7970354892953166, 4.074243040747149, 2.732584564332372 ], [ 0.7970354892953164, 13.694775014252851, 0.33775631066762796 ], [ -0.7970354892953164, 15.854095869252852, 3.404231165667628 ], [ -0.7970354892953166, 6.2335638957471495, 5.799059419332372 ], [ -2.4944509031350925, 11.291227220707695, 4.046262345196267 ], [ -2.494450903135092, 10.796432544292307, 5.157028239803734 ], [ 2.494450903135092, 8.637111689292306, 2.090553384803734 ], [ 2.4944509031350925, 9.131906365707694, 0.9797874901962662 ], [ -1.8523110307503878, 11.199084442879988, 1.8529571860501077 ], [ -1.852311030750388, 6.56993361212001, 1.2173836889498926 ], [ 1.852311030750388, 8.72925446712001, 4.283858543949892 ], [ 1.8523110307503878, 13.358405297879987, 4.919432041050108 ], [ 0.20162732155294372, 5.163555898916108, 2.517982541854123 ], [ 0.20162732155294405, 12.605462156083892, 0.5523583331458772 ], [ -0.20162732155294405, 14.76478301108389, 3.618833188145877 ], [ -0.20162732155294372, 7.322876753916108, 5.5844573968541225 ], [ -0.8536002018147204, 14.489408897306735, 5.927724875753196 ], [ -0.8536002018147201, 7.598250867693264, 3.2755657092468047 ], [ 0.8536002018147201, 5.438930012693264, 0.2090908542468047 ], [ 0.8536002018147204, 12.330088042306734, 2.8612500207531952 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.66926304, 0, 0 ], [ 0, 1.93380456, -0.03301305 ], [ 0, -0.03301302, 0.86321238 ] ]
-146.977682
-158.497682
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00539951, 0.00230959, -0.0467971 ], [ 0.00539951, -0.00230959, 0.0467971 ], [ -0.00539951, -0.00230959, 0.0467971 ], [ -0.00539951, 0.00230959, -0.0467971 ], [ 0.0012522, -0.01178702, 0.02182337 ], [ 0.0012522, 0.01178702, -0.02182337 ], [ -0.0012522, 0.01178702, -0.02182337 ], [ -0.0012522, -0.01178702, 0.02182337 ], [ -0.0012843, -0.01974486, 0.00545443 ], [ -0.0012843, 0.01974486, -0.00545443 ], [ 0.0012843, 0.01974486, -0.00545443 ], [ 0.0012843, -0.01974486, 0.00545443 ], [ -0.0093728, 0.00720886, -0.00507057 ], [ -0.0093728, -0.00720886, 0.00507057 ], [ 0.0093728, -0.00720886, 0.00507057 ], [ 0.0093728, 0.00720886, -0.00507057 ], [ 0.00813409, -0.00597196, 0.00500991 ], [ 0.00813409, 0.00597196, -0.00500991 ], [ -0.00813409, 0.00597196, -0.00500991 ], [ -0.00813409, -0.00597196, 0.00500991 ] ]
pbe
true
15
agm005266151-pbe-401
401
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.30135731, 7.8077943, 0.00299036 ], [ -3.30135731, 7.8077943, 0.00299036 ], [ 0, 4.32110221, 6.134156 ] ]
agm005266151
[ [ 1.650678655, 3.90389715, 0.00149518 ], [ -1.650678655, 6.064448255, 3.06857318 ], [ 0.7965083100031853, 4.076045890005004, 2.7330881315730555 ], [ 0.7965083100031851, 13.700093814994997, 0.339970588426944 ], [ -0.7965083100031851, 15.860644919994998, 3.407048588426944 ], [ -0.7965083100031853, 6.236596995005003, 5.8001661315730555 ], [ -2.4940339515306933, 11.29579045827166, 4.048379588011046 ], [ -2.4940339515306937, 10.80145145672834, 5.158835131988954 ], [ 2.4940339515306937, 8.640900351728341, 2.091757131988954 ], [ 2.4940339515306933, 9.135239353271661, 0.9813015880110456 ], [ -1.8519348768707349, 11.20346292705169, 1.8546585213463747 ], [ -1.8519348768707349, 6.572676777948312, 1.2184001986536255 ], [ 1.8519348768707349, 8.733227882948313, 4.2854781986536254 ], [ 1.8519348768707349, 13.36401403205169, 4.921736521346374 ], [ 0.20142914696663228, 5.16542175115319, 2.5187283698227145 ], [ 0.20142914696663228, 12.610717953846812, 0.5543303501772856 ], [ -0.20142914696663228, 14.771269058846812, 3.6214083501772856 ], [ -0.20142914696663228, 7.32597285615319, 5.5858063698227145 ], [ -0.8525567735979791, 14.49643070423376, 5.930954571980069 ], [ -0.8525567735979792, 7.6008112107662384, 3.2762601480199303 ], [ 0.8525567735979792, 5.440260105766239, 0.20918214801993038 ], [ 0.8525567735979791, 12.33587959923376, 2.86387657198007 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.69133057, 0, 0 ], [ 0, 1.9207665, -0.09453809 ], [ 0, -0.09453821, 0.83376648 ] ]
-146.977859
-158.497859
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00747138, -0.01010371, -0.02880117 ], [ 0.00747138, 0.01010371, 0.02880117 ], [ -0.00747138, 0.01010371, 0.02880117 ], [ -0.00747138, -0.01010371, -0.02880117 ], [ 0.00190744, 0.01275518, -0.03334803 ], [ 0.00190744, -0.01275518, 0.03334803 ], [ -0.00190744, -0.01275518, 0.03334803 ], [ -0.00190744, 0.01275518, -0.03334803 ], [ -0.00253975, -0.0171255, 0.00493343 ], [ -0.00253975, 0.0171255, -0.00493343 ], [ 0.00253975, 0.0171255, -0.00493343 ], [ 0.00253975, -0.0171255, 0.00493343 ], [ -0.00998372, 0.01170374, -0.00816403 ], [ -0.00998372, -0.01170374, 0.00816403 ], [ 0.00998372, -0.01170374, 0.00816403 ], [ 0.00998372, 0.01170374, -0.00816403 ], [ 0.00847105, -0.00482762, 0.00443786 ], [ 0.00847105, 0.00482762, -0.00443786 ], [ -0.00847105, 0.00482762, -0.00443786 ], [ -0.00847105, -0.00482762, 0.00443786 ] ]
pbe
true
15
agm005266151-pbe-402
402
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.30030063, 7.81056199, 0.00398382 ], [ -3.30030063, 7.81056199, 0.00398382 ], [ 0, 4.32341401, 6.13528939 ] ]
agm005266151
[ [ 1.650150315, 3.905280995, 0.00199191 ], [ -1.650150315, 6.066988, 3.069636605 ], [ 0.7960130071792767, 4.077739674903587, 2.7335612227287918 ], [ 0.796013007179277, 13.705091310096414, 0.34205111227120805 ], [ -0.796013007179277, 15.866798315096414, 3.4096958072712082 ], [ -0.7960130071792767, 6.239446679903587, 5.801205917728791 ], [ -2.4936420740995766, 11.300077899967736, 4.050368826537018 ], [ -2.4936420740995766, 10.806167095032265, 5.16053289846298 ], [ 2.4936420740995766, 8.644460090032265, 2.092888203462981 ], [ 2.4936420740995766, 9.138370894967736, 0.9827241315370187 ], [ -1.851581424702527, 11.207576634587994, 1.856256952127212 ], [ -1.851581424702527, 6.575254350412006, 1.2193553828727879 ], [ 1.851581424702527, 8.736961355412006, 4.287000077872787 ], [ 1.851581424702527, 13.369283639587994, 4.923901647127212 ], [ 0.20124295956361082, 5.167174732188411, 2.519429018292964 ], [ 0.20124295956361093, 12.615656252811588, 0.5561833167070355 ], [ -0.20124295956361093, 14.777363257811587, 3.6238280117070354 ], [ -0.20124295956361082, 7.328881737188411, 5.5870737132929635 ], [ -0.8515766375649125, 14.503028490159707, 5.933989260554737 ], [ -0.8515766375649128, 7.603216504840292, 3.2769124644452625 ], [ 0.8515766375649128, 5.441509499840293, 0.20926776944526249 ], [ 0.8515766375649125, 12.341321485159707, 2.866344565554737 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.7337439, 0, 0 ], [ 0, 1.92288634, -0.15732383 ], [ 0, -0.15732383, 0.82128907 ] ]
-146.97794
-158.49794
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00949981, -0.0220969, -0.01175708 ], [ 0.00949981, 0.0220969, 0.01175708 ], [ -0.00949981, 0.0220969, 0.01175708 ], [ -0.00949981, -0.0220969, -0.01175708 ], [ 0.00243911, 0.03576092, -0.08530685 ], [ 0.00243911, -0.03576092, 0.08530685 ], [ -0.00243911, -0.03576092, 0.08530685 ], [ -0.00243911, 0.03576092, -0.08530685 ], [ -0.00380434, -0.0146561, 0.00438999 ], [ -0.00380434, 0.0146561, -0.00438999 ], [ 0.00380434, 0.0146561, -0.00438999 ], [ 0.00380434, -0.0146561, 0.00438999 ], [ -0.01067081, 0.01588385, -0.01107537 ], [ -0.01067081, -0.01588385, 0.01107537 ], [ 0.01067081, -0.01588385, 0.01107537 ], [ 0.01067081, 0.01588385, -0.01107537 ], [ 0.00867533, -0.00349787, 0.00405874 ], [ 0.00867533, 0.00349787, -0.00405874 ], [ -0.00867533, 0.00349787, -0.00405874 ], [ -0.00867533, -0.00349787, 0.00405874 ] ]
pbe
true
15
agm005266151-pbe-403
403
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.29973648, 7.81256896, 0.00454108 ], [ -3.29973648, 7.81256896, 0.00454108 ], [ 0, 4.32496227, 6.13606701 ] ]
agm005266151
[ [ 1.64986824, 3.90628448, 0.00227054 ], [ -1.64986824, 6.068765615, 3.070304045 ], [ 0.7957610507882257, 4.078863309634786, 2.7338482629142082 ], [ 0.7957610507882253, 13.708755745365213, 0.3432674020857914 ], [ -0.7957610507882253, 15.871236880365213, 3.4113009070857916 ], [ -0.7957610507882257, 6.241344444634787, 5.8018817679142085 ], [ -2.49344923684321, 11.303231720363366, 4.051348692031112 ], [ -2.4934492368432095, 10.809349604636635, 5.161833982968887 ], [ 2.4934492368432095, 8.646868469636635, 2.093800477968887 ], [ 2.49344923684321, 9.140750585363365, 0.9833151870311128 ], [ -1.851416804145696, 11.21049328762408, 1.8572083871819989 ], [ -1.8514168041456962, 6.577125767375921, 1.2199072778180011 ], [ 1.8514168041456962, 8.73960690237592, 4.2879407828180005 ], [ 1.851416804145696, 13.37297442262408, 4.925241892181999 ], [ 0.2011073233835904, 5.168490275422956, 2.5198439316955676 ], [ 0.2011073233835905, 12.619128779577045, 0.5572717333044319 ], [ -0.2011073233835905, 14.781609914577045, 3.6253052383044317 ], [ -0.2011073233835904, 7.330971410422956, 5.587877436695568 ], [ -0.8509892682118225, 14.507584834789423, 5.935858499696388 ], [ -0.8509892682118224, 7.6049964902105796, 3.277324175303612 ], [ 0.8509892682118224, 5.442515355210579, 0.2092906703036121 ], [ 0.8509892682118225, 12.345103699789423, 2.8678249946963876 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.70034362, 0, 0 ], [ 0, 1.61692194, 0.00387439 ], [ 0, 0.00387435, 0.43949659 ] ]
-146.978083
-158.498083
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00656887, -0.02023202, -0.00708448 ], [ 0.00656887, 0.02023202, 0.00708448 ], [ -0.00656887, 0.02023202, 0.00708448 ], [ -0.00656887, -0.02023202, -0.00708448 ], [ 0.00257448, 0.02655272, -0.06413544 ], [ 0.00257448, -0.02655272, 0.06413544 ], [ -0.00257448, -0.02655272, 0.06413544 ], [ -0.00257448, 0.02655272, -0.06413544 ], [ -0.00446666, -0.01220036, 0.00239219 ], [ -0.00446666, 0.01220036, -0.00239219 ], [ 0.00446666, 0.01220036, -0.00239219 ], [ 0.00446666, -0.01220036, 0.00239219 ], [ -0.00734145, 0.01164468, -0.01195433 ], [ -0.00734145, -0.01164468, 0.01195433 ], [ 0.00734145, -0.01164468, 0.01195433 ], [ 0.00734145, 0.01164468, -0.01195433 ], [ 0.007605, -0.0008338, 0.00354474 ], [ 0.007605, 0.0008338, -0.00354474 ], [ -0.007605, 0.0008338, -0.00354474 ], [ -0.007605, -0.0008338, 0.00354474 ] ]
pbe
true
15
agm005266151-pbe-404
404
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.29804404, 7.81858986, 0.00621286 ], [ -3.29804404, 7.81858986, 0.00621286 ], [ 0, 4.32960706, 6.13839987 ] ]
agm005266151
[ [ 1.64902202, 3.90929493, 0.00310643 ], [ -1.64902202, 6.07409846, 3.0723063649999998 ], [ 0.7950053558201037, 4.08223384005248, 2.7347093319135376 ], [ 0.7950053558201038, 13.719749409947521, 0.3469163230864625 ], [ -0.7950053558201038, 15.884552939947522, 3.4161162580864626 ], [ -0.7950053558201037, 6.24703737005248, 5.803909266913537 ], [ -2.492870352678411, 11.31269304809568, 4.05428794726022 ], [ -2.492870352678411, 10.818897261904322, 5.16573757773978 ], [ 2.492870352678411, 8.654093731904322, 2.09653764273978 ], [ 2.492870352678411, 9.14788951809568, 0.9850880122602201 ], [ -1.8509226034930515, 11.219242831065598, 1.8600625589089077 ], [ -1.8509226034930515, 6.582740418934404, 1.221563096091092 ], [ 1.8509226034930515, 8.747543948934403, 4.2907630310910925 ], [ 1.8509226034930515, 13.384046361065597, 4.929262493908908 ], [ 0.2007005242082165, 5.172436666558328, 2.521088496781863 ], [ 0.20070052420821627, 12.629546583441673, 0.5605371582181371 ], [ -0.20070052420821627, 14.794350113441673, 3.629737093218137 ], [ -0.2007005242082165, 7.337240196558327, 5.590288431781863 ], [ -0.8492279701946976, 14.52125492507273, 5.941466730703762 ], [ -0.8492279701946971, 7.610335384927271, 3.2785587942962384 ], [ 0.8492279701946971, 5.44553185492727, 0.2093588592962384 ], [ 0.8492279701946976, 12.35645139507273, 2.8722667957037613 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.50978166, 0, 0 ], [ 0, 0.70959268, 0.51270952 ], [ 0, 0.51270956, -0.73721094 ] ]
-146.978379
-158.498379
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00225371, -0.01500691, 0.00853485 ], [ -0.00225371, 0.01500691, -0.00853485 ], [ 0.00225371, 0.01500691, -0.00853485 ], [ 0.00225371, -0.01500691, 0.00853485 ], [ 0.00321661, -0.00124809, 0.00042264 ], [ 0.00321661, 0.00124809, -0.00042264 ], [ -0.00321661, 0.00124809, -0.00042264 ], [ -0.00321661, -0.00124809, 0.00042264 ], [ -0.00634179, -0.00606423, -0.00305189 ], [ -0.00634179, 0.00606423, 0.00305189 ], [ 0.00634179, 0.00606423, 0.00305189 ], [ 0.00634179, -0.00606423, -0.00305189 ], [ 0.00258411, -0.00118803, -0.01434725 ], [ 0.00258411, 0.00118803, 0.01434725 ], [ -0.00258411, 0.00118803, 0.01434725 ], [ -0.00258411, -0.00118803, -0.01434725 ], [ 0.00633256, 0.0068561, 0.00331269 ], [ 0.00633256, -0.0068561, -0.00331269 ], [ -0.00633256, -0.0068561, -0.00331269 ], [ -0.00633256, 0.0068561, 0.00331269 ] ]
pbe
true
15
agm005266151-pbe-405
405
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.29465916, 7.83063166, 0.00955641 ], [ -3.29465916, 7.83063166, 0.00955641 ], [ 0, 4.33889663, 6.14306558 ] ]
agm005266151
[ [ 1.64732958, 3.91531583, 0.004778205 ], [ -1.64732958, 6.084764144999999, 3.076310995 ], [ 0.7934946406207237, 4.088973115372636, 2.7364304340744745 ], [ 0.793494640620724, 13.741738519627363, 0.3542151759255255 ], [ -0.793494640620724, 15.911186834627363, 3.425747965925525 ], [ -0.7934946406207237, 6.2584214303726355, 5.807963224074475 ], [ -2.4917111867980806, 11.331614983298786, 4.060166101074368 ], [ -2.49171118679808, 10.837993281701216, 5.173545088925632 ], [ 2.49171118679808, 8.668544966701216, 2.102012298925632 ], [ 2.4917111867980806, 9.162166668298786, 0.9886333110743678 ], [ -1.8499332942339444, 11.236741112247197, 1.8657706858053833 ], [ -1.8499332942339444, 6.593970522752803, 1.2248749241946166 ], [ 1.8499332942339444, 8.763418837752804, 4.296407714194617 ], [ 1.8499332942339444, 13.406189427247195, 4.9373034758053835 ], [ 0.19988759722244054, 5.180327269166097, 2.523576646930562 ], [ 0.19988759722244076, 12.650384365833903, 0.5670689630694381 ], [ -0.19988759722244076, 14.819832680833903, 3.6386017530694383 ], [ -0.19988759722244054, 7.349775584166096, 5.595109436930562 ], [ -0.8457080036293045, 14.548599989822954, 5.952685386737917 ], [ -0.8457080036293045, 7.621008275177047, 3.281025803262083 ], [ 0.8457080036293045, 5.451559960177047, 0.2094930132620831 ], [ 0.8457080036293045, 12.379151674822953, 2.881152596737917 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.16951812, 0, 0 ], [ 0, -1.19183212, 1.49370431 ], [ 0, 1.49370423, -3.14372559 ] ]
-146.978296
-158.498296
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01948205, -0.00518434, 0.03910574 ], [ -0.01948205, 0.00518434, -0.03910574 ], [ 0.01948205, 0.00518434, -0.03910574 ], [ 0.01948205, -0.00518434, 0.03910574 ], [ 0.00400919, -0.05653562, 0.12815433 ], [ 0.00400919, 0.05653562, -0.12815433 ], [ -0.00400919, 0.05653562, -0.12815433 ], [ -0.00400919, -0.05653562, 0.12815433 ], [ -0.01048161, 0.00635671, -0.01313947 ], [ -0.01048161, -0.00635671, 0.01313947 ], [ 0.01048161, -0.00635671, 0.01313947 ], [ 0.01048161, 0.00635671, -0.01313947 ], [ 0.02257955, -0.02687329, -0.01948573 ], [ 0.02257955, 0.02687329, 0.01948573 ], [ -0.02257955, 0.02687329, 0.01948573 ], [ -0.02257955, -0.02687329, -0.01948573 ], [ 0.00264572, 0.02188719, 0.00236955 ], [ 0.00264572, -0.02188719, -0.00236955 ], [ -0.00264572, -0.02188719, -0.00236955 ], [ -0.00264572, 0.02188719, 0.00236955 ] ]
pbe
true
15
agm005266151-pbe-406
406
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.29664963, 7.82355052, 0.00759025 ], [ -3.29664963, 7.82355052, 0.00759025 ], [ 0, 4.33343393, 6.14032192 ] ]
agm005266151
[ [ 1.648324815, 3.91177526, 0.003795125 ], [ -1.648324815, 6.078492225, 3.073956085 ], [ 0.7943832768947656, 4.085009474622184, 2.7354180094976277 ], [ 0.7943832768947652, 13.728808530377817, 0.3499234505023723 ], [ -0.7943832768947652, 15.895525495377818, 3.420084410502372 ], [ -0.7943832768947656, 6.251726439622184, 5.805578969497628 ], [ -2.4923923270329476, 11.320487755867791, 4.05670933614384 ], [ -2.4923923270329476, 10.82676417913221, 5.168954043856159 ], [ 2.4923923270329476, 8.660047214132211, 2.0987930838561595 ], [ 2.4923923270329476, 9.15377079086779, 0.9865483761438407 ], [ -1.850514699341686, 11.22645096158239, 1.8624139574784953 ], [ -1.8505146993416859, 6.58736704341761, 1.2229275025215045 ], [ 1.8505146993416859, 8.75408400841761, 4.293088462521505 ], [ 1.850514699341686, 13.39316792658239, 4.932574917478496 ], [ 0.2003658481014069, 5.17568647125419, 2.522113160347243 ], [ 0.200365848101407, 12.638131533745812, 0.5632282996527569 ], [ -0.200365848101407, 14.80484849874581, 3.6333892596527573 ], [ -0.2003658481014069, 7.342403436254189, 5.592274120347242 ], [ -0.847778847219905, 14.532521425253478, 5.9460890329983815 ], [ -0.8477788472199049, 7.614730509746522, 3.2795743470016188 ], [ 0.8477788472199049, 5.448013544746523, 0.2094133870016187 ], [ 0.847778847219905, 12.365804460253479, 2.875928072998381 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.38841774, 0, 0 ], [ 0, -0.08059673, 0.90937601 ], [ 0, 0.90937595, -1.73469039 ] ]
-146.978454
-158.498454
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00928226, -0.01118938, 0.02088603 ], [ -0.00928226, 0.01118938, -0.02088603 ], [ 0.00928226, 0.01118938, -0.02088603 ], [ 0.00928226, -0.01118938, 0.02088603 ], [ 0.00326948, -0.02419325, 0.05302108 ], [ 0.00326948, 0.02419325, -0.05302108 ], [ -0.00326948, 0.02419325, -0.05302108 ], [ -0.00326948, -0.02419325, 0.05302108 ], [ -0.008393, -0.00104099, -0.00736016 ], [ -0.008393, 0.00104099, 0.00736016 ], [ 0.008393, 0.00104099, 0.00736016 ], [ 0.008393, -0.00104099, -0.00736016 ], [ 0.01043223, -0.01183053, -0.01650587 ], [ 0.01043223, 0.01183053, 0.01650587 ], [ -0.01043223, 0.01183053, 0.01650587 ], [ -0.01043223, -0.01183053, -0.01650587 ], [ 0.00457171, 0.01355708, 0.00320894 ], [ 0.00457171, -0.01355708, -0.00320894 ], [ -0.00457171, -0.01355708, -0.00320894 ], [ -0.00457171, 0.01355708, 0.00320894 ] ]
pbe
true
15
agm005266151-pbe-407
407
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.29564889, 7.82728969, 0.00893996 ], [ -3.29564889, 7.82728969, 0.00893996 ], [ 0, 4.33656323, 6.14149349 ] ]
agm005266151
[ [ 1.647824445, 3.913644845, 0.00446998 ], [ -1.647824445, 6.08192646, 3.075216725 ], [ 0.7938808856417862, 4.087156708770046, 2.7360123750915313 ], [ 0.7938808856417863, 13.735704286229952, 0.3526142899084688 ], [ -0.7938808856417863, 15.903985901229952, 3.4233610349084693 ], [ -0.7938808856417862, 6.255438323770046, 5.806759120091532 ], [ -2.4920573089908507, 11.326409105293962, 4.058940000250255 ], [ -2.4920573089908507, 10.833015119706038, 5.171180154749746 ], [ 2.4920573089908507, 8.664733504706039, 2.1004334097497463 ], [ 2.4920573089908507, 9.158127490293962, 0.9881932552502541 ], [ -1.8502773097898113, 11.231952503647403, 1.8644627427609037 ], [ -1.8502773097898113, 6.590908491352597, 1.2241639222390963 ], [ 1.8502773097898113, 8.759190106352596, 4.294910667239097 ], [ 1.8502773097898113, 13.400234118647402, 4.935209487760904 ], [ 0.20016509124335125, 5.1781789221711225, 2.522827330257543 ], [ 0.2001650912433517, 12.644682072828878, 0.5657993347424572 ], [ -0.2001650912433517, 14.812963687828878, 3.636546079742457 ], [ -0.20016509124335125, 7.346460537171122, 5.593574075257543 ], [ -0.8466723692122069, 14.541317415216302, 5.949735263447407 ], [ -0.8466723692122067, 7.618106809783701, 3.2803848915525937 ], [ 0.8466723692122067, 5.4498251947837, 0.2096381465525933 ], [ 0.8466723692122069, 12.373035800216302, 2.878988518447407 ] ]
[{"mass": null, "name": "C", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["C"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
[ "Co", "Co", "C", "C", "C", "C", "C", "C", "C", "C", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2024-05-07 00:00:00
[ 0.36363636363636365, 0.09090909090909091, 0.5454545454545454 ]
[ [ 0.27669711, 0, 0 ], [ 0, -0.47622858, 0.92401276 ], [ 0, 0.92401279, -1.8267061 ] ]
-146.978576
-158.498576
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01266857, -0.00884016, 0.02811777 ], [ -0.01266857, 0.00884016, -0.02811777 ], [ 0.01266857, 0.00884016, -0.02811777 ], [ 0.01266857, -0.00884016, 0.02811777 ], [ 0.00337841, -0.01548069, 0.03460295 ], [ 0.00337841, 0.01548069, -0.03460295 ], [ -0.00337841, 0.01548069, -0.03460295 ], [ -0.00337841, -0.01548069, 0.03460295 ], [ -0.0103259, 0.00264328, -0.00720861 ], [ -0.0103259, -0.00264328, 0.00720861 ], [ 0.0103259, -0.00264328, 0.00720861 ], [ 0.0103259, 0.00264328, -0.00720861 ], [ 0.01603966, -0.01942686, -0.01679916 ], [ 0.01603966, 0.01942686, 0.01679916 ], [ -0.01603966, 0.01942686, 0.01679916 ], [ -0.01603966, -0.01942686, -0.01679916 ], [ 0.00350988, 0.01713301, 0.00281665 ], [ 0.00350988, -0.01713301, -0.00281665 ], [ -0.00350988, -0.01713301, -0.00281665 ], [ -0.00350988, 0.01713301, 0.00281665 ] ]
pbe
true
15
agm005266151-pbe-408
408
2