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
[ [ 3.29264669, 7.8385072, 0.01298912 ], [ -3.29264669, 7.8385072, 0.01298912 ], [ 0, 4.34595114, 6.14500817 ] ]
agm005266151
[ [ 1.646323345, 3.9192536, 0.00649456 ], [ -1.646323345, 6.0922291699999995, 3.078998645 ], [ 0.792374438154493, 4.093596806560704, 2.7377947100324698 ], [ 0.7923744381544933, 13.756393163439293, 0.3606876149675302 ], [ -0.7923744381544933, 15.929368733439293, 3.43319169996753 ], [ -0.792374438154493, 6.266572376560704, 5.81029879503247 ], [ -2.4910511289372286, 11.344172442709286, 4.065631679232348 ], [ -2.4910511289372286, 10.851768667290711, 5.177858815767651 ], [ 2.4910511289372286, 8.678793097290711, 2.105354730767652 ], [ 2.4910511289372286, 9.171196872709288, 0.9931275942323485 ], [ -1.8495642667929333, 11.248456214890874, 1.8706088583042055 ], [ -1.849564266792933, 6.601533755109125, 1.2278734666957944 ], [ 1.849564266792933, 8.774509325109126, 4.300377551695794 ], [ 1.8495642667929333, 13.421431784890874, 4.943112943304206 ], [ 0.19956316714607059, 5.185653822680771, 2.524969058891771 ], [ 0.19956316714607025, 12.664336147319228, 0.5735132661082287 ], [ -0.19956316714607025, 14.837311717319228, 3.646017351108229 ], [ -0.19956316714607059, 7.358629392680771, 5.597473143891771 ], [ -0.8433553100174358, 14.567709885351444, 5.960675787060408 ], [ -0.8433553100174356, 7.6282312246485535, 3.2828147079395915 ], [ 0.8433553100174356, 5.455255654648553, 0.21031062293959168 ], [ 0.8433553100174358, 12.394734315351446, 2.888171702060408 ] ]
[{"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 ]
[ [ -0.01973195, 0, 0 ], [ 0, -1.72460944, 0.93928556 ], [ 0, 0.93928552, -2.13306321 ] ]
-146.978771
-158.498771
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02235544, -0.00180302, 0.04896673 ], [ -0.02235544, 0.00180302, -0.04896673 ], [ 0.02235544, 0.00180302, -0.04896673 ], [ 0.02235544, -0.00180302, 0.04896673 ], [ 0.0034701, 0.010529, -0.02133867 ], [ 0.0034701, -0.010529, 0.02133867 ], [ -0.0034701, -0.010529, 0.02133867 ], [ -0.0034701, 0.010529, -0.02133867 ], [ -0.01718173, 0.01352884, -0.00648712 ], [ -0.01718173, -0.01352884, 0.00648712 ], [ 0.01718173, -0.01352884, 0.00648712 ], [ 0.01718173, 0.01352884, -0.00648712 ], [ 0.03222918, -0.04291669, -0.01833761 ], [ 0.03222918, 0.04291669, 0.01833761 ], [ -0.03222918, 0.04291669, 0.01833761 ], [ -0.03222918, -0.04291669, -0.01833761 ], [ 0.00113283, 0.02847726, 0.00234148 ], [ 0.00113283, -0.02847726, -0.00234148 ], [ -0.00113283, -0.02847726, -0.00234148 ], [ -0.00113283, 0.02847726, 0.00234148 ] ]
pbe
true
15
agm005266151-pbe-409
409
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.53272219, 7.16092816, -0.028384 ], [ -3.53272219, 7.16092816, -0.028384 ], [ 0, 3.94447966, 6.09243607 ] ]
agm005266151
[ [ 1.766361095, 3.58046408, -0.014192 ], [ -1.766361095, 5.55270391, 3.032026035 ], [ 0.7899511610525743, 3.7484397737985837, 2.6816810585462005 ], [ 0.7899511610525747, 12.545656376201416, 0.3077689764537992 ], [ -0.7899511610525747, 14.517896206201417, 3.3539870114537984 ], [ -0.7899511610525743, 5.720679603798584, 5.727899093546201 ], [ -2.7155197512826534, 10.354271058915469, 3.981907733854431 ], [ -2.715519751282653, 9.88430475108453, 5.099978371145569 ], [ 2.715519751282653, 7.91206492108453, 2.0537603361455683 ], [ 2.7155197512826534, 8.38203122891547, 0.9356896988544315 ], [ -2.0183348367983953, 10.255238248783451, 1.8101788127714236 ], [ -2.0183348367983953, 6.038857901216551, 1.1792712222285764 ], [ 2.0183348367983953, 8.011097731216552, 4.225489257228577 ], [ 2.0183348367983953, 12.22747807878345, 4.856396847771423 ], [ 0.11744983576373125, 4.78063014085298, 2.4165196643265134 ], [ 0.11744983576373125, 11.51346600914702, 0.5729303706734865 ], [ -0.11744983576373125, 13.48570583914702, 3.6191484056734864 ], [ -0.11744983576373125, 6.752869970852981, 5.462737699326513 ], [ -1.078042324050429, 13.09579194166743, 5.8445837248228925 ], [ -1.0780423240504289, 7.142783868332569, 3.2373023801771073 ], [ 1.0780423240504289, 5.170544038332569, 0.1910843451771075 ], [ 1.078042324050429, 11.12355211166743, 2.7983656898228926 ] ]
[{"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 ]
[ [ -0.08748394, 0, 0 ], [ 0, -1.14771307, -0.08673557 ], [ 0, -0.08673555, 1.39986177 ] ]
-146.824712
-158.344712
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.05019753, -0.02226279, 0.0335065 ], [ 0.05019753, 0.02226279, -0.0335065 ], [ -0.05019753, 0.02226279, -0.0335065 ], [ -0.05019753, -0.02226279, 0.0335065 ], [ -0.01306796, 0.16097662, -0.32958985 ], [ -0.01306796, -0.16097662, 0.32958985 ], [ 0.01306796, -0.16097662, 0.32958985 ], [ 0.01306796, 0.16097662, -0.32958985 ], [ 0.02326362, 0.00045549, -0.02296328 ], [ 0.02326362, -0.00045549, 0.02296328 ], [ -0.02326362, -0.00045549, 0.02296328 ], [ -0.02326362, 0.00045549, -0.02296328 ], [ 0.01632937, -0.01397932, 0.08021584 ], [ 0.01632937, 0.01397932, -0.08021584 ], [ -0.01632937, 0.01397932, -0.08021584 ], [ -0.01632937, -0.01397932, 0.08021584 ], [ 0.02780915, 0.03980122, 0.00298872 ], [ 0.02780915, -0.03980122, -0.00298872 ], [ -0.02780915, -0.03980122, -0.00298872 ], [ -0.02780915, 0.03980122, 0.00298872 ] ]
pbe
true
15
agm005266151-pbe-41
41
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.29131989, 7.84280289, 0.01514236 ], [ -3.29131989, 7.84280289, 0.01514236 ], [ 0, 4.35001902, 6.14611745 ] ]
agm005266151
[ [ 1.645659945, 3.921401445, 0.00757118 ], [ -1.645659945, 6.096410955, 3.080629905 ], [ 0.7915865260065947, 4.096214820497731, 2.738754314934781 ], [ 0.7915865260065948, 13.764400469502268, 0.3645891300652188 ], [ -0.7915865260065948, 15.939409979502269, 3.437647855065219 ], [ -0.7915865260065947, 6.271224330497731, 5.811813039934782 ], [ -2.4905865227135036, 11.351311420244517, 4.068572494121018 ], [ -2.4905865227135044, 10.859322889755482, 5.180888400878982 ], [ 2.4905865227135044, 8.684313379755482, 2.107829675878982 ], [ 2.4905865227135036, 9.176301910244517, 0.9955137691210181 ], [ -1.8493427168682686, 11.254960896426399, 1.8736165686200745 ], [ -1.8493427168682686, 6.605654393573599, 1.2297268763799252 ], [ 1.8493427168682686, 8.780663903573599, 4.3027856013799255 ], [ 1.8493427168682686, 13.4299704064264, 4.946675293620075 ], [ 0.199474358604119, 5.188401168990936, 2.5257911722111 ], [ 0.19947435860411922, 12.672214121009063, 0.5775522727889005 ], [ -0.19947435860411922, 14.847223631009062, 3.6506109977889003 ], [ -0.199474358604119, 7.363410678990936, 5.5988498972111005 ], [ -0.8418849373503596, 14.578576322670862, 5.965574381178981 ], [ -0.8418849373503593, 7.632057987329137, 3.2838865138210194 ], [ 0.8418849373503593, 5.457048477329137, 0.21082778882101963 ], [ 0.8418849373503596, 12.403566812670864, 2.8925156561789804 ] ]
[{"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 ]
[ [ 0.0472137, 0, 0 ], [ 0, -1.50676319, 0.75040918 ], [ 0, 0.75040911, -1.86111959 ] ]
-146.979058
-158.499058
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01560797, -0.00692258, 0.04116607 ], [ -0.01560797, 0.00692258, -0.04116607 ], [ 0.01560797, 0.00692258, -0.04116607 ], [ 0.01560797, -0.00692258, 0.04116607 ], [ 0.0034805, 0.01066857, -0.02158562 ], [ 0.0034805, -0.01066857, 0.02158562 ], [ -0.0034805, -0.01066857, 0.02158562 ], [ -0.0034805, 0.01066857, -0.02158562 ], [ -0.01810981, 0.0134633, -0.00400501 ], [ -0.01810981, -0.0134633, 0.00400501 ], [ 0.01810981, -0.0134633, 0.00400501 ], [ 0.01810981, 0.0134633, -0.00400501 ], [ 0.02707897, -0.03383175, -0.01949473 ], [ 0.02707897, 0.03383175, 0.01949473 ], [ -0.02707897, 0.03383175, 0.01949473 ], [ -0.02707897, -0.03383175, -0.01949473 ], [ 0.00199633, 0.02833071, 0.0024095 ], [ 0.00199633, -0.02833071, -0.0024095 ], [ -0.00199633, -0.02833071, -0.0024095 ], [ -0.00199633, 0.02833071, 0.0024095 ] ]
pbe
true
15
agm005266151-pbe-410
410
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.28733947, 7.85568995, 0.02160209 ], [ -3.28733947, 7.85568995, 0.02160209 ], [ 0, 4.36222268, 6.14944531 ] ]
agm005266151
[ [ 1.643669735, 3.927844975, 0.010801045 ], [ -1.643669735, 6.108956315, 3.0855237 ], [ 0.7892245585777841, 4.104066750455053, 2.741632233711653 ], [ 0.789224558577784, 13.788424489544948, 0.3762946012883468 ], [ -0.789224558577784, 15.969535829544947, 3.4510172562883463 ], [ -0.7892245585777841, 6.285178090455053, 5.816354888711653 ], [ -2.4891907052162177, 11.372727282790365, 4.077394604832406 ], [ -2.489190705216217, 10.881986637209636, 5.189977540167593 ], [ 2.489190705216217, 8.700875297209636, 2.1152548851675936 ], [ 2.4891907052162177, 9.191615942790364, 1.0026719498324066 ], [ -1.8486762125841123, 11.274474007445447, 1.882639357579046 ], [ -1.848676212584112, 6.618017232554554, 1.235287477420954 ], [ 1.848676212584112, 8.799128572554554, 4.310010132420954 ], [ 1.8486762125841123, 13.455585347445448, 4.957362012579046 ], [ 0.19920784087279508, 5.196637874350394, 2.5282556482494947 ], [ 0.19920784087279486, 12.695853365649606, 0.5896711867505054 ], [ -0.19920784087279486, 14.876964705649607, 3.6643938417505058 ], [ -0.19920784087279508, 7.377749214350395, 5.602978303249494 ], [ -0.8374779682285471, 14.61118450348908, 5.980273169863944 ], [ -0.8374779682285473, 7.643529416510923, 3.2870989751360553 ], [ 0.8374779682285473, 5.462418076510922, 0.21237632013605517 ], [ 0.8374779682285471, 12.43007316348908, 2.905550514863945 ] ]
[{"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 ]
[ [ 0.30013248, 0, 0 ], [ 0, -0.89498241, 0.16222646 ], [ 0, 0.16222646, -1.0649411 ] ]
-146.979756
-158.499756
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00429791, -0.02177994, 0.01778767 ], [ 0.00429791, 0.02177994, -0.01778767 ], [ -0.00429791, 0.02177994, -0.01778767 ], [ -0.00429791, -0.02177994, 0.01778767 ], [ 0.00335355, 0.01072629, -0.02208547 ], [ 0.00335355, -0.01072629, 0.02208547 ], [ -0.00335355, -0.01072629, 0.02208547 ], [ -0.00335355, 0.01072629, -0.02208547 ], [ -0.02138494, 0.01327476, 0.00298522 ], [ -0.02138494, -0.01327476, -0.00298522 ], [ 0.02138494, -0.01327476, -0.00298522 ], [ 0.02138494, 0.01327476, 0.00298522 ], [ 0.01147605, -0.00695289, -0.02312162 ], [ 0.01147605, 0.00695289, 0.02312162 ], [ -0.01147605, 0.00695289, 0.02312162 ], [ -0.01147605, -0.00695289, -0.02312162 ], [ 0.00384909, 0.02901239, 0.00233239 ], [ 0.00384909, -0.02901239, -0.00233239 ], [ -0.00384909, -0.02901239, -0.00233239 ], [ -0.00384909, 0.02901239, 0.00233239 ] ]
pbe
true
15
agm005266151-pbe-411
411
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27937864, 7.88146409, 0.03452155 ], [ -3.27937864, 7.88146409, 0.03452155 ], [ 0, 4.38662998, 6.15610102 ] ]
agm005266151
[ [ 1.63968932, 3.940732045, 0.017260775 ], [ -1.63968932, 6.134047035, 3.095311285 ], [ 0.784507387526816, 4.119761974915641, 2.74738439470199 ], [ 0.784507387526816, 13.836481195084357, 0.39970921529801 ], [ -0.784507387526816, 16.029796185084358, 3.477759725298011 ], [ -0.784507387526816, 6.313076964915641, 5.82543490470199 ], [ -2.4863912384231535, 11.415554115192954, 4.095037031183905 ], [ -2.4863912384231535, 10.927319034807049, 5.208157598816096 ], [ 2.4863912384231535, 8.734004044807048, 2.130107088816095 ], [ 2.4863912384231535, 9.222239125192953, 1.0169865211839049 ], [ -1.8473356402304322, 11.313496386625705, 1.900683345721019 ], [ -1.847335640230432, 6.642746783374296, 1.2464102642789807 ], [ 1.847335640230432, 8.836061773374295, 4.324460774278981 ], [ 1.8473356402304322, 13.506811376625704, 4.9787338557210195 ], [ 0.19867502246634317, 5.213090259990574, 2.5331771060795 ], [ 0.19867502246634317, 12.743152910009426, 0.6139165039204999 ], [ -0.19867502246634317, 14.936467900009426, 3.6919670139205003 ], [ -0.19867502246634317, 7.406405249990575, 5.611227616079501 ], [ -0.8286803882511113, 14.676435098673313, 6.009682652311039 ], [ -0.8286803882511113, 7.66643805132669, 3.293511977688962 ], [ 0.8286803882511113, 5.47312306132669, 0.21546146768896152 ], [ 0.8286803882511113, 12.483120108673312, 2.9316321423110385 ] ]
[{"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 ]
[ [ 0.75744517, 0, 0 ], [ 0, 0.3297799, -1.01550284 ], [ 0, -1.01550274, 0.51376886 ] ]
-146.980431
-158.500431
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.04437837, -0.05251005, -0.02965761 ], [ 0.04437837, 0.05251005, 0.02965761 ], [ -0.04437837, 0.05251005, 0.02965761 ], [ -0.04437837, -0.05251005, -0.02965761 ], [ 0.00303215, 0.0108857, -0.02308723 ], [ 0.00303215, -0.0108857, 0.02308723 ], [ -0.00303215, -0.0108857, 0.02308723 ], [ -0.00303215, 0.0108857, -0.02308723 ], [ -0.02797129, 0.01320765, 0.01717011 ], [ -0.02797129, -0.01320765, -0.01717011 ], [ 0.02797129, -0.01320765, -0.01717011 ], [ 0.02797129, 0.01320765, 0.01717011 ], [ -0.01973198, 0.0474842, -0.03077355 ], [ -0.01973198, -0.0474842, 0.03077355 ], [ 0.01973198, -0.0474842, 0.03077355 ], [ 0.01973198, 0.0474842, -0.03077355 ], [ 0.00815428, 0.02921345, 0.00162694 ], [ 0.00815428, -0.02921345, -0.00162694 ], [ -0.00815428, -0.02921345, -0.00162694 ], [ -0.00815428, 0.02921345, 0.00162694 ] ]
pbe
true
15
agm005266151-pbe-412
412
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.2770266, 7.88986462, 0.03811733 ], [ -3.2770266, 7.88986462, 0.03811733 ], [ 0, 4.39410516, 6.15814849 ] ]
agm005266151
[ [ 1.6385133, 3.94493231, 0.019058665 ], [ -1.6385133, 6.14198489, 3.0981329100000004 ], [ 0.783376715148462, 4.124299097845798, 2.748825475114605 ], [ 0.7833767151484619, 13.852482722154202, 0.4064834298853952 ], [ -0.7833767151484619, 16.0495353021542, 3.4855576748853956 ], [ -0.783376715148462, 6.321351677845798, 5.827899720114605 ], [ -2.485611764615196, 11.429285222099416, 4.09987938495471 ], [ -2.485611764615196, 10.941601757900584, 5.213578010045291 ], [ 2.485611764615196, 8.744549177900582, 2.1345037650452903 ], [ 2.485611764615196, 9.232232642099415, 1.0208051399547102 ], [ -1.8472112305749904, 11.3261750838232, 1.9058761768319765 ], [ -1.8472112305749901, 6.650606736176801, 1.2494327281680235 ], [ 1.8472112305749901, 8.8476593161768, 4.3285069731680235 ], [ 1.8472112305749904, 13.5232276638232, 4.984950421831977 ], [ 0.19837267516371004, 5.2186419334842435, 2.534269070059491 ], [ 0.19837267516371027, 12.758139886515757, 0.6210398349405089 ], [ -0.19837267516371027, 14.955192466515758, 3.7001140799405094 ], [ -0.19837267516371004, 7.415694513484244, 5.613343315059492 ], [ -0.8258754900158822, 14.697388602005269, 6.018298333335477 ], [ -0.825875490015882, 7.673498377994732, 3.295159061664524 ], [ 0.825875490015882, 5.476445797994732, 0.2160848166645237 ], [ 0.8258754900158822, 12.500336022005268, 2.939224088335476 ] ]
[{"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 ]
[ [ 0.70683996, 0, 0 ], [ 0, -0.04925384, -0.7573796 ], [ 0, -0.75737965, 0.87683554 ] ]
-146.98079
-158.50079
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.02300002, -0.01385046, -0.03458345 ], [ 0.02300002, 0.01385046, 0.03458345 ], [ -0.02300002, 0.01385046, 0.03458345 ], [ -0.02300002, -0.01385046, -0.03458345 ], [ 0.00253446, -0.00544358, 0.01777944 ], [ 0.00253446, 0.00544358, -0.01777944 ], [ -0.00253446, 0.00544358, -0.01777944 ], [ -0.00253446, -0.00544358, 0.01777944 ], [ -0.01703664, 0.00076411, 0.00559118 ], [ -0.01703664, -0.00076411, -0.00559118 ], [ 0.01703664, -0.00076411, -0.00559118 ], [ 0.01703664, 0.00076411, 0.00559118 ], [ -0.01049539, 0.02895869, -0.02478582 ], [ -0.01049539, -0.02895869, 0.02478582 ], [ 0.01049539, -0.02895869, 0.02478582 ], [ 0.01049539, 0.02895869, -0.02478582 ], [ 0.01116545, 0.0264652, 0.00067713 ], [ 0.01116545, -0.0264652, -0.00067713 ], [ -0.01116545, -0.0264652, -0.00067713 ], [ -0.01116545, 0.0264652, 0.00067713 ] ]
pbe
true
15
agm005266151-pbe-413
413
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27493648, 7.89732965, 0.04131268 ], [ -3.27493648, 7.89732965, 0.04131268 ], [ 0, 4.40074789, 6.15996796 ] ]
agm005266151
[ [ 1.63746824, 3.948664825, 0.02065634 ], [ -1.63746824, 6.14903877, 3.10064032 ], [ 0.7823722382676416, 4.12833002878008, 2.7501057130002886 ], [ 0.7823722382676417, 13.86670321621992, 0.4125036269997116 ], [ -0.7823722382676417, 16.06707716121992, 3.4924876069997124 ], [ -0.7823722382676416, 6.32870397378008, 5.830089693000288 ], [ -2.484918509527421, 11.44148674767031, 4.104182368297699 ], [ -2.4849185095274207, 10.954294387329691, 5.218394931702302 ], [ 2.4849185095274207, 8.75392044232969, 2.1384109517023013 ], [ 2.484918509527421, 9.24111280267031, 1.0241983882976988 ], [ -1.8471000025250912, 11.337441629552293, 1.9104907083835556 ], [ -1.8471000025250914, 6.657591615447706, 1.2521186316164443 ], [ 1.8471000025250914, 8.857965560447706, 4.332102611616445 ], [ 1.8471000025250912, 13.537815574552294, 4.990474688383555 ], [ 0.19810401886485596, 5.223573981570206, 2.5352390690186493 ], [ 0.19810401886485618, 12.771459263429794, 0.6273702709813505 ], [ -0.19810401886485618, 14.971833208429793, 3.7073542509813504 ], [ -0.19810401886485596, 7.4239479265702055, 5.615223049018651 ], [ -0.8233842350573166, 14.716011538814625, 6.025955509316008 ], [ -0.8233842350573168, 7.679769596185374, 3.296621790683993 ], [ 0.8233842350573168, 5.479395651185374, 0.2166378106839928 ], [ 0.8233842350573166, 12.515637593814624, 2.9459715293160076 ] ]
[{"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 ]
[ [ 0.68699984, 0, 0 ], [ 0, -0.36304722, -0.52987746 ], [ 0, -0.52987742, 1.21659221 ] ]
-146.980954
-158.500954
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00416945, 0.02002645, -0.039118 ], [ 0.00416945, -0.02002645, 0.039118 ], [ -0.00416945, -0.02002645, 0.039118 ], [ -0.00416945, 0.02002645, -0.039118 ], [ 0.00197074, -0.01996649, 0.05399947 ], [ 0.00197074, 0.01996649, -0.05399947 ], [ -0.00197074, 0.01996649, -0.05399947 ], [ -0.00197074, -0.01996649, 0.05399947 ], [ -0.00741156, -0.01017042, -0.0048943 ], [ -0.00741156, 0.01017042, 0.0048943 ], [ 0.00741156, 0.01017042, 0.0048943 ], [ 0.00741156, -0.01017042, -0.0048943 ], [ -0.00242805, 0.01239569, -0.01924868 ], [ -0.00242805, -0.01239569, 0.01924868 ], [ 0.00242805, -0.01239569, 0.01924868 ], [ 0.00242805, 0.01239569, -0.01924868 ], [ 0.01319484, 0.02446358, -0.00022723 ], [ 0.01319484, -0.02446358, 0.00022723 ], [ -0.01319484, -0.02446358, 0.00022723 ], [ -0.01319484, 0.02446358, -0.00022723 ] ]
pbe
true
15
agm005266151-pbe-414
414
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27075624, 7.91225971, 0.04770338 ], [ -3.27075624, 7.91225971, 0.04770338 ], [ 0, 4.41403334, 6.1636069 ] ]
agm005266151
[ [ 1.63537812, 3.956129855, 0.02385169 ], [ -1.63537812, 6.163146525, 3.10565514 ], [ 0.7803646289218655, 4.136387324838037, 2.7526645513146164 ], [ 0.7803646289218658, 13.895148765161963, 0.4245456586853834 ], [ -0.7803646289218658, 16.10216543516196, 3.5063491086853835 ], [ -0.7803646289218655, 6.343403994838037, 5.834468001314618 ], [ -2.4835296626093015, 11.46588836572323, 4.112787903247293 ], [ -2.4835296626093015, 10.97968106427677, 5.2280292067527085 ], [ 2.4835296626093015, 8.77266439427677, 2.146225756752708 ], [ 2.4835296626093015, 9.25887169572323, 1.0309844532472923 ], [ -1.8468748345017452, 11.359974145946236, 1.9197193524975562 ], [ -1.8468748345017456, 6.671561944053763, 1.2574908575024437 ], [ 1.8468748345017456, 8.878578614053762, 4.339294307502444 ], [ 1.8468748345017452, 13.566990815946236, 5.001522802497556 ], [ 0.19756715241170875, 5.233432300965404, 2.537177296248262 ], [ 0.19756715241170886, 12.798103789034597, 0.6400329137517379 ], [ -0.19756715241170886, 15.005120459034597, 3.721836363751738 ], [ -0.19756715241170875, 7.440448970965404, 5.618980746248262 ], [ -0.8184066966266186, 14.753268913974484, 6.041273653584521 ], [ -0.8184066966266185, 7.692300516025515, 3.2995434564154795 ], [ 0.8184066966266185, 5.485283846025515, 0.2177400064154796 ], [ 0.8184066966266186, 12.546252243974486, 2.959470203584521 ] ]
[{"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 ]
[ [ 0.6692908, 0, 0 ], [ 0, -0.98060373, -0.07760859 ], [ 0, -0.07760865, 1.90926095 ] ]
-146.980834
-158.500834
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.03335934, 0.08772158, -0.04804431 ], [ -0.03335934, -0.08772158, 0.04804431 ], [ 0.03335934, -0.08772158, 0.04804431 ], [ 0.03335934, 0.08772158, -0.04804431 ], [ 0.00072394, -0.04895418, 0.12646089 ], [ 0.00072394, 0.04895418, -0.12646089 ], [ -0.00072394, 0.04895418, -0.12646089 ], [ -0.00072394, -0.04895418, 0.12646089 ], [ 0.01181357, -0.03203335, -0.02621742 ], [ 0.01181357, 0.03203335, 0.02621742 ], [ -0.01181357, 0.03203335, 0.02621742 ], [ -0.01181357, -0.03203335, -0.02621742 ], [ 0.01337584, -0.02057338, -0.00786003 ], [ 0.01337584, 0.02057338, 0.00786003 ], [ -0.01337584, 0.02057338, 0.00786003 ], [ -0.01337584, -0.02057338, -0.00786003 ], [ 0.01677674, 0.02107813, -0.00195935 ], [ 0.01677674, -0.02107813, 0.00195935 ], [ -0.01677674, -0.02107813, 0.00195935 ], [ -0.01677674, 0.02107813, -0.00195935 ] ]
pbe
true
15
agm005266151-pbe-415
415
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27373836, 7.90160882, 0.04314434 ], [ -3.27373836, 7.90160882, 0.04314434 ], [ 0, 4.40455569, 6.16101093 ] ]
agm005266151
[ [ 1.63686918, 3.95080441, 0.02157217 ], [ -1.63686918, 6.153082254999999, 3.1020776349999997 ], [ 0.7817974965281843, 4.130637167633141, 2.750838318697279 ], [ 0.7817974965281844, 13.874858317366858, 0.4159558263027211 ], [ -0.7817974965281844, 16.07713616236686, 3.496461291302721 ], [ -0.7817974965281843, 6.3329150126331415, 5.831343783697279 ], [ -2.4845192658723114, 11.44847974967794, 4.106648583511041 ], [ -2.484519265872312, 10.96157142532206, 5.2211564914889586 ], [ 2.484519265872312, 8.759293580322058, 2.1406510264889587 ], [ 2.4845192658723114, 9.24620190467794, 1.0261431185110417 ], [ -1.8470340817193591, 11.343899381187828, 1.913135549087748 ], [ -1.8470340817193591, 6.661596103812173, 1.253658595912252 ], [ 1.8470340817193591, 8.863873948812174, 4.334164060912252 ], [ 1.8470340817193591, 13.546177226187826, 4.993641014087748 ], [ 0.19795032199913043, 5.226396648532883, 2.535793753071863 ], [ 0.19795032199913054, 12.779098836467115, 0.631000391928137 ], [ -0.19795032199913054, 14.981376681467115, 3.7115058569281367 ], [ -0.19795032199913043, 7.428674493532882, 5.6162992180718625 ], [ -0.8219601443146511, 14.72669591941612, 6.030347833139114 ], [ -0.8219601443146511, 7.68335525558388, 3.297457241860885 ], [ 0.8219601443146511, 5.481077410583881, 0.216951776860885 ], [ 0.8219601443146511, 12.524418074416118, 2.9498423681391146 ] ]
[{"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 ]
[ [ 0.68570751, 0, 0 ], [ 0, -0.52536678, -0.40071677 ], [ 0, -0.40071675, 1.42358481 ] ]
-146.980976
-158.500976
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00658652, 0.03942229, -0.04173668 ], [ -0.00658652, -0.03942229, 0.04173668 ], [ 0.00658652, -0.03942229, 0.04173668 ], [ 0.00658652, 0.03942229, -0.04173668 ], [ 0.00157962, -0.02823549, 0.07464537 ], [ 0.00157962, 0.02823549, -0.07464537 ], [ -0.00157962, 0.02823549, -0.07464537 ], [ -0.00157962, -0.02823549, 0.07464537 ], [ -0.00208287, -0.01645565, -0.01093978 ], [ -0.00208287, 0.01645565, 0.01093978 ], [ 0.00208287, 0.01645565, 0.01093978 ], [ 0.00208287, -0.01645565, -0.01093978 ], [ 0.00200412, 0.00287519, -0.01582892 ], [ 0.00200412, -0.00287519, 0.01582892 ], [ -0.00200412, -0.00287519, 0.01582892 ], [ -0.00200412, 0.00287519, -0.01582892 ], [ 0.01395175, 0.02322289, -0.00084205 ], [ 0.01395175, -0.02322289, 0.00084205 ], [ -0.01395175, -0.02322289, 0.00084205 ], [ -0.01395175, 0.02322289, -0.00084205 ] ]
pbe
true
15
agm005266151-pbe-416
416
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27104624, 7.91157273, 0.04730438 ], [ -3.27104624, 7.91157273, 0.04730438 ], [ 0, 4.41333678, 6.1640675 ] ]
agm005266151
[ [ 1.63552312, 3.955786365, 0.02365219 ], [ -1.63552312, 6.162454755, 3.10568594 ], [ 0.7804040530486815, 4.136279594208446, 2.75241910614713 ], [ 0.7804040530486818, 13.893534255791554, 0.42422340385287016 ], [ -0.7804040530486818, 16.100202645791555, 3.5062571538528697 ], [ -0.7804040530486815, 6.342947984208447, 5.834452856147129 ], [ -2.483688138907853, 11.464454349501185, 4.113324343982915 ], [ -2.483688138907853, 10.978696280498815, 5.227385666017085 ], [ 2.483688138907853, 8.772027890498814, 2.145351916017086 ], [ 2.483688138907853, 9.257785959501186, 1.0312905939829142 ], [ -1.8469990725157666, 11.358760747543956, 1.919256772226575 ], [ -1.8469990725157663, 6.671053102456042, 1.2573857377734252 ], [ 1.8469990725157663, 8.877721492456043, 4.339419487773425 ], [ 1.8469990725157666, 13.565429137543955, 5.001290522226575 ], [ 0.19760966039978234, 5.232925757764413, 2.5371154986913154 ], [ 0.1976096603997819, 12.796888092235587, 0.6395270113086847 ], [ -0.1976096603997819, 15.003556482235586, 3.7215607613086847 ], [ -0.19760966039978234, 7.439594147764413, 5.619149248691315 ], [ -0.8184644751265133, 14.751769716784203, 6.041099343062981 ], [ -0.8184644751265137, 7.691380913215797, 3.299610666937019 ], [ 0.8184644751265137, 5.484712523215797, 0.217576916937019 ], [ 0.8184644751265133, 12.545101326784204, 2.959065593062981 ] ]
[{"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 ]
[ [ 0.6611195, 0, 0 ], [ 0, -0.69529671, -0.28525708 ], [ 0, -0.28525708, 1.94215637 ] ]
-146.981256
-158.501256
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02364141, 0.0548534, -0.01460977 ], [ -0.02364141, -0.0548534, 0.01460977 ], [ 0.02364141, -0.0548534, 0.01460977 ], [ 0.02364141, 0.0548534, -0.01460977 ], [ 0.00116076, 0.01424107, -0.01837941 ], [ 0.00116076, -0.01424107, 0.01837941 ], [ -0.00116076, -0.01424107, 0.01837941 ], [ -0.00116076, 0.01424107, -0.01837941 ], [ 0.00685233, -0.02466221, -0.02186748 ], [ 0.00685233, 0.02466221, 0.02186748 ], [ -0.00685233, 0.02466221, 0.02186748 ], [ -0.00685233, -0.02466221, -0.02186748 ], [ 0.00846511, -0.01095068, -0.01120006 ], [ 0.00846511, 0.01095068, 0.01120006 ], [ -0.00846511, 0.01095068, 0.01120006 ], [ -0.00846511, -0.01095068, -0.01120006 ], [ 0.01813802, 0.01790173, -0.00234951 ], [ 0.01813802, -0.01790173, 0.00234951 ], [ -0.01813802, -0.01790173, 0.00234951 ], [ -0.01813802, 0.01790173, -0.00234951 ] ]
pbe
true
15
agm005266151-pbe-417
417
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27005354, 7.91524686, 0.04883837 ], [ -3.27005354, 7.91524686, 0.04883837 ], [ 0, 4.41657475, 6.16519459 ] ]
agm005266151
[ [ 1.63502677, 3.95762343, 0.024419185 ], [ -1.63502677, 6.165910804999999, 3.10701648 ], [ 0.7798903399046317, 4.138359992708585, 2.753001902910831 ], [ 0.779890339904632, 13.900421102291414, 0.4272721320891689 ], [ -0.779890339904632, 16.108708477291415, 3.5098694270891686 ], [ -0.7798903399046317, 6.346647367708584, 5.835599197910831 ], [ -2.4833815014598333, 11.470344724404292, 4.115785968687749 ], [ -2.4833815014598333, 10.985011120595708, 5.229682656312251 ], [ 2.4833815014598333, 8.776723745595708, 2.1470853613122505 ], [ 2.4833815014598333, 9.26205734940429, 1.0331886736877491 ], [ -1.8469859832701763, 11.364240607634974, 1.9215139063771978 ], [ -1.8469859832701758, 6.674540487365025, 1.2587601286228016 ], [ 1.8469859832701758, 8.882827862365025, 4.341357423622801 ], [ 1.8469859832701763, 13.572527982634973, 5.004111201377198 ], [ 0.19748405967108262, 5.235332970239421, 2.5376027497120055 ], [ 0.19748405967108296, 12.803448124760578, 0.642671285287994 ], [ -0.19748405967108296, 15.01173549976058, 3.7252685802879935 ], [ -0.19748405967108262, 7.44362034523942, 5.620200044712005 ], [ -0.8171757846725305, 14.76101620167515, 6.045064127214649 ], [ -0.8171757846725305, 7.6943396433248505, 3.30040449778535 ], [ 0.8171757846725305, 5.486052268324851, 0.21780720278535037 ], [ 0.8171757846725305, 12.55272882667515, 2.9624668322146497 ] ]
[{"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 ]
[ [ 0.7090041, 0, 0 ], [ 0, -0.68541701, -0.24039111 ], [ 0, -0.24039117, 2.1992815 ] ]
-146.981287
-158.501287
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02987314, 0.06019726, -0.00467748 ], [ -0.02987314, -0.06019726, 0.00467748 ], [ 0.02987314, -0.06019726, 0.00467748 ], [ 0.02987314, 0.06019726, -0.00467748 ], [ 0.00096947, 0.02990371, -0.0528242 ], [ 0.00096947, -0.02990371, 0.0528242 ], [ -0.00096947, -0.02990371, 0.0528242 ], [ -0.00096947, 0.02990371, -0.0528242 ], [ 0.01025068, -0.02769114, -0.02656009 ], [ 0.01025068, 0.02769114, 0.02656009 ], [ -0.01025068, 0.02769114, 0.02656009 ], [ -0.01025068, -0.02769114, -0.02656009 ], [ 0.01029919, -0.01584453, -0.00917944 ], [ 0.01029919, 0.01584453, 0.00917944 ], [ -0.01029919, 0.01584453, 0.00917944 ], [ -0.01029919, -0.01584453, -0.00917944 ], [ 0.01908206, 0.01670836, -0.00258691 ], [ 0.01908206, -0.01670836, 0.00258691 ], [ -0.01908206, -0.01670836, 0.00258691 ], [ -0.01908206, 0.01670836, -0.00258691 ] ]
pbe
true
15
agm005266151-pbe-418
418
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26742678, 7.92526523, 0.05306033 ], [ -3.26742678, 7.92526523, 0.05306033 ], [ 0, 4.42542703, 6.16945555 ] ]
agm005266151
[ [ 1.63371339, 3.962632615, 0.026530165 ], [ -1.63371339, 6.175346129999999, 3.11125794 ], [ 0.7781990172576606, 4.144557917350261, 2.7550454197765957 ], [ 0.7781990172576609, 13.918686057649738, 0.4358030152234043 ], [ -0.7781990172576609, 16.131399572649737, 3.5205307902234044 ], [ -0.7781990172576606, 6.357271432350261, 5.839773194776597 ], [ -2.4826490929892193, 11.486673448476036, 4.122838943132567 ], [ -2.4826490929892198, 11.001997556523962, 5.237465041867433 ], [ 2.4826490929892198, 8.789284041523963, 2.1527372668674323 ], [ 2.4826490929892193, 9.273959933476036, 1.0381111681325677 ], [ -1.8469638612299646, 11.378913312390226, 1.9278257904755083 ], [ -1.8469638612299644, 6.6843306626097725, 1.2630226445244919 ], [ 1.8469638612299644, 8.897044177609772, 4.347750419524492 ], [ 1.8469638612299646, 13.591626827390227, 5.012553565475509 ], [ 0.197234460033903, 5.241695819701885, 2.539270953349621 ], [ 0.19723446003390288, 12.821548155298114, 0.6515774816503792 ], [ -0.19723446003390288, 15.034261670298115, 3.736305256650379 ], [ -0.197234460033903, 7.454409334701885, 5.623998728349622 ], [ -0.8133839757954129, 14.786559636211097, 6.05715724091158 ], [ -0.8133839757954127, 7.702111368788904, 3.3031467440884215 ], [ 0.8133839757954127, 5.489397853788904, 0.21841896908842162 ], [ 0.8133839757954129, 12.573846121211096, 2.972429465911578 ] ]
[{"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 ]
[ [ 0.69227465, 0, 0 ], [ 0, -0.5675329, 0.04576794 ], [ 0, 0.04576787, 0.85042748 ] ]
-146.981689
-158.501689
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01626434, 0.02999805, 0.00807604 ], [ -0.01626434, -0.02999805, -0.00807604 ], [ 0.01626434, -0.02999805, -0.00807604 ], [ 0.01626434, 0.02999805, 0.00807604 ], [ 0.00147626, 0.02253, -0.0344745 ], [ 0.00147626, -0.02253, 0.0344745 ], [ -0.00147626, -0.02253, 0.0344745 ], [ -0.00147626, 0.02253, -0.0344745 ], [ 0.00521769, -0.0194307, -0.02052942 ], [ 0.00521769, 0.0194307, 0.02052942 ], [ -0.00521769, 0.0194307, 0.02052942 ], [ -0.00521769, -0.0194307, -0.02052942 ], [ 0.0009607, -0.00029282, -0.01061462 ], [ 0.0009607, 0.00029282, 0.01061462 ], [ -0.0009607, 0.00029282, 0.01061462 ], [ -0.0009607, -0.00029282, -0.01061462 ], [ 0.02298033, 0.00858454, -0.0044276 ], [ 0.02298033, -0.00858454, 0.0044276 ], [ -0.02298033, -0.00858454, 0.0044276 ], [ -0.02298033, 0.00858454, -0.0044276 ] ]
pbe
true
15
agm005266151-pbe-419
419
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.53185059, 7.16131128, -0.02900432 ], [ -3.53185059, 7.16131128, -0.02900432 ], [ 0, 3.94416039, 6.09179593 ] ]
agm005266151
[ [ 1.765925295, 3.58065564, -0.01450216 ], [ -1.765925295, 5.552735835, 3.031395805 ], [ 0.7900715157694217, 3.7483397339606315, 2.6814129192238534 ], [ 0.790071515769422, 12.546363021039369, 0.3064764057761465 ], [ -0.790071515769422, 14.518443216039369, 3.3523743707761464 ], [ -0.7900715157694217, 5.720419928960631, 5.727310884223853 ], [ -2.714837658789482, 10.354329162489915, 3.980695715036602 ], [ -2.714837658789482, 9.884533982510085, 5.098989539963398 ], [ 2.714837658789482, 7.912453787510084, 2.0530915749633976 ], [ 2.714837658789482, 8.382248967489915, 0.9347977500366023 ], [ -2.0176668107472304, 10.255685358258019, 1.8089081882973181 ], [ -2.017666810747231, 6.03901739674198, 1.1789811367026817 ], [ 2.017666810747231, 8.01109759174198, 4.224879101702682 ], [ 2.0176668107472304, 12.227765553258017, 4.854806153297318 ], [ 0.11780985633878183, 4.7807401919700405, 2.416507693687197 ], [ 0.11780985633878194, 11.51396256302996, 0.571381631312803 ], [ -0.11780985633878194, 13.48604275802996, 3.617279596312803 ], [ -0.11780985633878183, 6.75282038697004, 5.462405658687197 ], [ -1.0771748732233921, 13.096363567872835, 5.8427529782752305 ], [ -1.0771748732233921, 7.142499577127164, 3.2369322767247697 ], [ 1.0771748732233921, 5.170419382127164, 0.19103431172476948 ], [ 1.0771748732233921, 11.124283372872835, 2.7968550132752306 ] ]
[{"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 ]
[ [ 0.05696302, 0, 0 ], [ 0, -0.92067233, -0.0939182 ], [ 0, -0.0939182, 1.55978575 ] ]
-146.825189
-158.345189
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.04884083, -0.02104303, 0.02716671 ], [ 0.04884083, 0.02104303, -0.02716671 ], [ -0.04884083, 0.02104303, -0.02716671 ], [ -0.04884083, -0.02104303, 0.02716671 ], [ -0.01160453, 0.15331601, -0.31112956 ], [ -0.01160453, -0.15331601, 0.31112956 ], [ 0.01160453, -0.15331601, 0.31112956 ], [ 0.01160453, 0.15331601, -0.31112956 ], [ 0.02488264, -0.00247326, -0.01921901 ], [ 0.02488264, 0.00247326, 0.01921901 ], [ -0.02488264, 0.00247326, 0.01921901 ], [ -0.02488264, -0.00247326, -0.01921901 ], [ 0.01558114, -0.01260301, 0.08004189 ], [ 0.01558114, 0.01260301, -0.08004189 ], [ -0.01558114, 0.01260301, -0.08004189 ], [ -0.01558114, -0.01260301, 0.08004189 ], [ 0.02740828, 0.03728577, 0.00318889 ], [ 0.02740828, -0.03728577, -0.00318889 ], [ -0.02740828, -0.03728577, -0.00318889 ], [ -0.02740828, 0.03728577, 0.00318889 ] ]
pbe
true
15
agm005266151-pbe-42
42
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26403517, 7.93820071, 0.05851162 ], [ -3.26403517, 7.93820071, 0.05851162 ], [ 0, 4.43685688, 6.1749572 ] ]
agm005266151
[ [ 1.632017585, 3.969100355, 0.02925581 ], [ -1.632017585, 6.187528795, 3.11673441 ], [ 0.7760166259041471, 4.15255859873586, 2.7576830394704683 ], [ 0.776016625904147, 13.94227126126414, 0.4468188005295317 ], [ -0.776016625904147, 16.160699701264143, 3.534297400529532 ], [ -0.7760166259041471, 6.370987038735859, 5.845161639470468 ], [ -2.481701754752407, 11.507755638400981, 4.131945094966801 ], [ -2.481701754752407, 11.023931101599018, 5.247513945033199 ], [ 2.481701754752407, 8.80550266159902, 2.160035345033199 ], [ 2.481701754752407, 9.289327198400981, 1.0444664949668008 ], [ -1.846933313198357, 11.397856582949608, 1.9359748022868284 ], [ -1.846933313198357, 6.696973277050392, 1.2685270377131714 ], [ 1.846933313198357, 8.915401717050393, 4.356005637713172 ], [ 1.846933313198357, 13.616285022949608, 5.023453402286828 ], [ 0.19691232205153952, 5.249906556373324, 2.541422527186215 ], [ 0.1969123220515394, 12.844923303626677, 0.6630793128137844 ], [ -0.1969123220515394, 15.063351743626676, 3.7505579128137843 ], [ -0.19691232205153952, 7.468334996373324, 5.628901127186216 ], [ -0.8084922743894691, 14.81955068750744, 6.072776018938755 ], [ -0.8084922743894689, 7.71213605249256, 3.306683021061245 ], [ 0.8084922743894689, 5.49370761249256, 0.219204421061245 ], [ 0.8084922743894691, 12.60112224750744, 2.985297418938755 ] ]
[{"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 ]
[ [ 0.70396235, 0, 0 ], [ 0, -0.35767675, 0.41542791 ], [ 0, 0.41542796, -0.84091872 ] ]
-146.981905
-158.501905
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00134929, -0.00956764, 0.02473885 ], [ 0.00134929, 0.00956764, -0.02473885 ], [ -0.00134929, 0.00956764, -0.02473885 ], [ -0.00134929, -0.00956764, 0.02473885 ], [ 0.00208504, 0.0129827, -0.01061522 ], [ 0.00208504, -0.0129827, 0.01061522 ], [ -0.00208504, -0.0129827, 0.01061522 ], [ -0.00208504, 0.0129827, -0.01061522 ], [ -0.00096147, -0.00883999, -0.01362308 ], [ -0.00096147, 0.00883999, 0.01362308 ], [ 0.00096147, 0.00883999, 0.01362308 ], [ 0.00096147, -0.00883999, -0.01362308 ], [ -0.01189567, 0.02048024, -0.01228085 ], [ -0.01189567, -0.02048024, 0.01228085 ], [ 0.01189567, -0.02048024, 0.01228085 ], [ 0.01189567, 0.02048024, -0.01228085 ], [ 0.02785015, -0.00102046, -0.00616645 ], [ 0.02785015, 0.00102046, 0.00616645 ], [ -0.02785015, 0.00102046, 0.00616645 ], [ -0.02785015, -0.00102046, -0.00616645 ] ]
pbe
true
15
agm005266151-pbe-420
420
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.2635211, 7.94080484, 0.06007772 ], [ -3.2635211, 7.94080484, 0.06007772 ], [ 0, 4.43952414, 6.17583725 ] ]
agm005266151
[ [ 1.63176055, 3.97040242, 0.03003886 ], [ -1.63176055, 6.19016449, 3.117957485 ], [ 0.7756026481936531, 4.154205833381505, 2.758502218101737 ], [ 0.7756026481936535, 13.947165916618495, 0.4495718468982626 ], [ -0.7756026481936535, 16.166927986618493, 3.5374904718982627 ], [ -0.7756026481936531, 6.373967903381505, 5.846420843101737 ], [ -2.4816511532506964, 11.512383196012376, 4.134001870261526 ], [ -2.481651153250696, 11.028512693987622, 5.249909444738474 ], [ 2.481651153250696, 8.808750623987624, 2.1619908197384743 ], [ 2.4816511532506964, 9.292621126012376, 1.046083245261526 ], [ -1.8470757929611963, 11.401657192659046, 1.9379719659125516 ], [ -1.8470757929611958, 6.699714557340953, 1.2701020990874483 ], [ 1.8470757929611958, 8.919476627340954, 4.3580207240874484 ], [ 1.8470757929611963, 13.621419262659046, 5.025890590912552 ], [ 0.19671591404892008, 5.251902274953316, 2.54176794590857 ], [ 0.1967159140489203, 12.849469475046684, 0.66630611909143 ], [ -0.1967159140489203, 15.069231545046684, 3.75422474409143 ], [ -0.19671591404892008, 7.471664344953317, 5.62968657090857 ], [ -0.8071336794646788, 14.826642302859202, 6.076316051249217 ], [ -0.8071336794646791, 7.714253587140797, 3.307595263750783 ], [ 0.8071336794646791, 5.494491517140797, 0.21967663875078308 ], [ 0.8071336794646788, 12.606880232859204, 2.988397426249217 ] ]
[{"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 ]
[ [ 0.48918129, 0, 0 ], [ 0, -0.81007049, 0.32712275 ], [ 0, 0.32712273, -1.08537537 ] ]
-146.98203
-158.50203
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00110697, 0.00105555, -0.00257667 ], [ 0.00110697, -0.00105555, 0.00257667 ], [ -0.00110697, -0.00105555, 0.00257667 ], [ -0.00110697, 0.00105555, -0.00257667 ], [ 0.00225962, -0.00319156, 0.02646693 ], [ 0.00225962, 0.00319156, -0.02646693 ], [ -0.00225962, 0.00319156, -0.02646693 ], [ -0.00225962, -0.00319156, 0.02646693 ], [ -0.00894375, -0.00064878, 0.00070052 ], [ -0.00894375, 0.00064878, -0.00070052 ], [ 0.00894375, 0.00064878, -0.00070052 ], [ 0.00894375, -0.00064878, 0.00070052 ], [ -0.00436733, 0.00469433, -0.00738738 ], [ -0.00436733, -0.00469433, 0.00738738 ], [ 0.00436733, -0.00469433, 0.00738738 ], [ 0.00436733, 0.00469433, -0.00738738 ], [ 0.02633553, -0.00071952, -0.00594308 ], [ 0.02633553, 0.00071952, 0.00594308 ], [ -0.02633553, 0.00071952, 0.00594308 ], [ -0.02633553, -0.00071952, -0.00594308 ] ]
pbe
true
15
agm005266151-pbe-421
421
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26317788, 7.9425435, 0.06112333 ], [ -3.26317788, 7.9425435, 0.06112333 ], [ 0, 4.44130495, 6.17642482 ] ]
agm005266151
[ [ 1.63158894, 3.97127175, 0.030561665 ], [ -1.63158894, 6.191924225, 3.118774075 ], [ 0.7753262674165163, 4.155305654920105, 2.759049070876629 ], [ 0.7753262674165162, 13.950433820079896, 0.4514099991233713 ], [ -0.7753262674165162, 16.171086295079895, 3.539622409123371 ], [ -0.7753262674165163, 6.375958129920106, 5.847261480876629 ], [ -2.4816173112437436, 11.515472937514087, 4.13537512501714 ], [ -2.481617311243744, 11.031571487485913, 5.2515087649828605 ], [ 2.481617311243744, 8.810919012485911, 2.16329635498286 ], [ 2.4816173112437436, 9.294820462514087, 1.04716271501714 ], [ -1.8471708845375363, 11.404194610110004, 1.9393053737300723 ], [ -1.8471708845375365, 6.701544864889997, 1.271153696269928 ], [ 1.8471708845375365, 8.922197339889998, 4.359366106269928 ], [ 1.8471708845375363, 13.624847085110003, 5.0275177837300715 ], [ 0.19658479976887677, 5.253234767999777, 2.541998545106663 ], [ 0.196584799768877, 12.852504707000223, 0.6684605248933374 ], [ -0.196584799768877, 15.073157182000223, 3.756672934893338 ], [ -0.19658479976887677, 7.473887242999777, 5.630210955106663 ], [ -0.8062267019287248, 14.83137736595461, 6.07867973162123 ], [ -0.8062267019287249, 7.715667059045389, 3.30820415837877 ], [ 0.8062267019287249, 5.495014584045389, 0.21999174837877003 ], [ 0.8062267019287248, 12.61072489095461, 2.9904673216212303 ] ]
[{"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 ]
[ [ 0.3333466, 0, 0 ], [ 0, -1.12509317, 0.27055865 ], [ 0, 0.27055866, -1.26577377 ] ]
-146.982059
-158.502059
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00099915, 0.00822183, -0.02065908 ], [ 0.00099915, -0.00822183, 0.02065908 ], [ -0.00099915, -0.00822183, 0.02065908 ], [ -0.00099915, 0.00822183, -0.02065908 ], [ 0.00245274, -0.01406057, 0.05131498 ], [ 0.00245274, 0.01406057, -0.05131498 ], [ -0.00245274, 0.01406057, -0.05131498 ], [ -0.00245274, -0.01406057, 0.05131498 ], [ -0.01422328, 0.00459749, 0.01053394 ], [ -0.01422328, -0.00459749, -0.01053394 ], [ 0.01422328, -0.00459749, -0.01053394 ], [ 0.01422328, 0.00459749, 0.01053394 ], [ 0.00082141, -0.00593652, -0.00418331 ], [ 0.00082141, 0.00593652, 0.00418331 ], [ -0.00082141, 0.00593652, 0.00418331 ], [ -0.00082141, -0.00593652, -0.00418331 ], [ 0.02557938, -0.00072556, -0.00567423 ], [ 0.02557938, 0.00072556, 0.00567423 ], [ -0.02557938, 0.00072556, 0.00567423 ], [ -0.02557938, -0.00072556, -0.00567423 ] ]
pbe
true
15
agm005266151-pbe-422
422
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26288779, 7.94387009, 0.06223631 ], [ -3.26288779, 7.94387009, 0.06223631 ], [ 0, 4.44290998, 6.17672051 ] ]
agm005266151
[ [ 1.631443895, 3.971935045, 0.031118155 ], [ -1.631443895, 6.193390035, 3.11947841 ], [ 0.7750711294527735, 4.1562560037629215, 2.7593879092695905 ], [ 0.7750711294527739, 13.952939166237078, 0.45344496573040954 ], [ -0.7750711294527739, 16.174394156237078, 3.5418052207304096 ], [ -0.7750711294527735, 6.37771099376292, 5.84774816426959 ], [ -2.4816077766293914, 11.517934394635098, 4.136872753335598 ], [ -2.481607776629392, 11.0341707553649, 5.252680631664402 ], [ 2.481607776629392, 8.812715765364901, 2.164320376664403 ], [ 2.4816077766293914, 9.296479404635098, 1.0485124983355976 ], [ -1.8473569457372403, 11.406182437489221, 1.9406890253321682 ], [ -1.8473569457372405, 6.703012732510779, 1.272143849667832 ], [ 1.8473569457372405, 8.92446772251078, 4.360504104667832 ], [ 1.8473569457372403, 13.627637427489221, 5.029049280332168 ], [ 0.19646297662105028, 5.254291821485224, 2.542129140153823 ], [ 0.19646297662105017, 12.854903348514773, 0.6707037348461771 ], [ -0.19646297662105017, 15.076358338514773, 3.7590639898461773 ], [ -0.19646297662105028, 7.475746811485224, 5.630489395153822 ], [ -0.805229381347063, 14.835378470873472, 6.080814340159959 ], [ -0.8052293813470635, 7.716726679126527, 3.3087390448400416 ], [ 0.8052293813470635, 5.495271689126527, 0.2203787898400414 ], [ 0.805229381347063, 12.613923480873472, 2.9924540851599586 ] ]
[{"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 ]
[ [ 0.26072529, 0, 0 ], [ 0, -1.16657841, 0.07259534 ], [ 0, 0.0725954, -0.89003134 ] ]
-146.982162
-158.502162
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00016671, 0.01029698, -0.02541751 ], [ 0.00016671, -0.01029698, 0.02541751 ], [ -0.00016671, -0.01029698, 0.02541751 ], [ -0.00016671, 0.01029698, -0.02541751 ], [ 0.0026228, -0.00105852, 0.02082478 ], [ 0.0026228, 0.00105852, -0.02082478 ], [ -0.0026228, 0.00105852, -0.02082478 ], [ -0.0026228, -0.00105852, 0.02082478 ], [ -0.01589978, 0.00621153, 0.01531859 ], [ -0.01589978, -0.00621153, -0.01531859 ], [ 0.01589978, -0.00621153, -0.01531859 ], [ 0.01589978, 0.00621153, 0.01531859 ], [ 0.00298983, -0.01092266, -0.00259709 ], [ 0.00298983, 0.01092266, 0.00259709 ], [ -0.00298983, 0.01092266, 0.00259709 ], [ -0.00298983, -0.01092266, -0.00259709 ], [ 0.02444012, -0.00092216, -0.00520087 ], [ 0.02444012, 0.00092216, 0.00520087 ], [ -0.02444012, 0.00092216, 0.00520087 ], [ -0.02444012, -0.00092216, -0.00520087 ] ]
pbe
true
15
agm005266151-pbe-423
423
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26254673, 7.94542981, 0.06354488 ], [ -3.26254673, 7.94542981, 0.06354488 ], [ 0, 4.44479706, 6.17706815 ] ]
agm005266151
[ [ 1.631273365, 3.972714905, 0.03177244 ], [ -1.631273365, 6.195113435, 3.1203065150000002 ], [ 0.7747711966768427, 4.157373455522398, 2.759786300954146 ], [ 0.7747711966768427, 13.955884694477602, 0.45583753404585414 ], [ -0.7747711966768427, 16.178283224477603, 3.544371609045854 ], [ -0.7747711966768427, 6.379771985522399, 5.848320375954146 ], [ -2.481596563445743, 11.520828321513353, 4.138633502208958 ], [ -2.4815965634457426, 11.03722688848665, 5.254058482791042 ], [ 2.4815965634457426, 8.814828358486649, 2.1655244077910414 ], [ 2.481596563445743, 9.298429791513353, 1.0500994272089585 ], [ -1.8475757108845126, 11.40851959364675, 1.9423157669975915 ], [ -1.8475757108845126, 6.70473855635325, 1.2733080680024087 ], [ 1.8475757108845126, 8.92713708635325, 4.361842143002409 ], [ 1.8475757108845126, 13.630918123646751, 5.030849841997591 ], [ 0.19631976917073946, 5.25553458264236, 2.5422826881210328 ], [ 0.19631976917073946, 12.857723567357642, 0.6733411468789673 ], [ -0.19631976917073946, 15.080122097357641, 3.7618752218789675 ], [ -0.19631976917073946, 7.477933112642361, 5.630816763121033 ], [ -0.8040568927657439, 14.840083055985712, 6.083324235257762 ], [ -0.8040568927657438, 7.717972154014288, 3.309367749742239 ], [ 0.8040568927657438, 5.4955736240142885, 0.2208336747422388 ], [ 0.8040568927657439, 12.617684525985712, 2.994790160257761 ] ]
[{"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 ]
[ [ 0.16166929, 0, 0 ], [ 0, -1.23042552, -0.15987144 ], [ 0, -0.15987146, -0.4585691 ] ]
-146.982236
-158.502236
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.000756, 0.01270879, -0.03105379 ], [ -0.000756, -0.01270879, 0.03105379 ], [ 0.000756, -0.01270879, 0.03105379 ], [ 0.000756, 0.01270879, -0.03105379 ], [ 0.00283727, 0.01426142, -0.01520745 ], [ 0.00283727, -0.01426142, 0.01520745 ], [ -0.00283727, -0.01426142, 0.01520745 ], [ -0.00283727, 0.01426142, -0.01520745 ], [ -0.01785545, 0.00805447, 0.02116396 ], [ -0.01785545, -0.00805447, -0.02116396 ], [ 0.01785545, -0.00805447, -0.02116396 ], [ 0.01785545, 0.00805447, 0.02116396 ], [ 0.00565633, -0.01682356, -0.00071952 ], [ 0.00565633, 0.01682356, 0.00071952 ], [ -0.00565633, 0.01682356, 0.00071952 ], [ -0.00565633, -0.01682356, -0.00071952 ], [ 0.02332463, -0.00143214, -0.00460897 ], [ 0.02332463, 0.00143214, 0.00460897 ], [ -0.02332463, 0.00143214, 0.00460897 ], [ -0.02332463, -0.00143214, -0.00460897 ] ]
pbe
true
15
agm005266151-pbe-424
424
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.2618646, 7.94854924, 0.06616202 ], [ -3.2618646, 7.94854924, 0.06616202 ], [ 0, 4.44857122, 6.17776344 ] ]
agm005266151
[ [ 1.6309323, 3.97427462, 0.03308101 ], [ -1.6309323, 6.19856023, 3.12196273 ], [ 0.77417143344369, 4.159607943222023, 2.7605829219622438 ], [ 0.7741714334436898, 13.961776146777977, 0.46062283803775617 ], [ -0.7741714334436898, 16.186061756777978, 3.5495045580377558 ], [ -0.77417143344369, 6.383893553222024, 5.849464641962244 ], [ -2.4815740064226484, 11.526616406226896, 4.142155051192164 ], [ -2.4815740064226475, 11.043338903773103, 5.256814148807835 ], [ 2.4815740064226475, 8.819053293773104, 2.167932428807835 ], [ 2.4815740064226484, 9.302330796226897, 1.0532733311921647 ], [ -1.8480130750369979, 11.413193479532847, 1.94556915926678 ], [ -1.8480130750369979, 6.708190610467153, 1.2756366007332198 ], [ 1.8480130750369979, 8.932476220467153, 4.36451832073322 ], [ 1.8480130750369979, 13.637479089532848, 5.03445087926678 ], [ 0.19603336537497595, 5.258019676017386, 2.542589860869444 ], [ 0.19603336537497595, 12.863364413982614, 0.6786158991305555 ], [ -0.19603336537497595, 15.087650023982613, 3.7674976191305554 ], [ -0.19603336537497595, 7.482305286017385, 5.6314715808694435 ], [ -0.8017124326768084, 14.849492971780961, 6.088344357218762 ], [ -0.8017124326768083, 7.72046233821904, 3.310624842781237 ], [ 0.8017124326768083, 5.49617672821904, 0.22174312278123717 ], [ 0.8017124326768084, 12.62520736178096, 2.9994626372187625 ] ]
[{"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 ]
[ [ -0.0252636, 0, 0 ], [ 0, -1.34195859, -0.62577893 ], [ 0, -0.625779, 0.41789927 ] ]
-146.982252
-158.502252
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00263405, 0.0175199, -0.04235204 ], [ -0.00263405, -0.0175199, 0.04235204 ], [ 0.00263405, -0.0175199, 0.04235204 ], [ 0.00263405, 0.0175199, -0.04235204 ], [ 0.0032403, 0.04502543, -0.08751514 ], [ 0.0032403, -0.04502543, 0.08751514 ], [ -0.0032403, -0.04502543, 0.08751514 ], [ -0.0032403, 0.04502543, -0.08751514 ], [ -0.02168158, 0.01187804, 0.03268111 ], [ -0.02168158, -0.01187804, -0.03268111 ], [ 0.02168158, -0.01187804, -0.03268111 ], [ 0.02168158, 0.01187804, 0.03268111 ], [ 0.01091584, -0.02852613, 0.00306735 ], [ 0.01091584, 0.02852613, -0.00306735 ], [ -0.01091584, 0.02852613, -0.00306735 ], [ -0.01091584, -0.02852613, 0.00306735 ], [ 0.0209135, -0.00213721, -0.00341649 ], [ 0.0209135, 0.00213721, 0.00341649 ], [ -0.0209135, 0.00213721, 0.00341649 ], [ -0.0209135, -0.00213721, -0.00341649 ] ]
pbe
true
15
agm005266151-pbe-425
425
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26216041, 7.94719646, 0.06502707 ], [ -3.26216041, 7.94719646, 0.06502707 ], [ 0, 4.44693451, 6.17746192 ] ]
agm005266151
[ [ 1.631080205, 3.97359823, 0.032513535 ], [ -1.631080205, 6.1970654849999995, 3.121244495 ], [ 0.7744315313909276, 4.158638865396533, 2.7602374062798924 ], [ 0.7744315313909276, 13.959221309603466, 0.4585476937201074 ], [ -0.7744315313909276, 16.182688564603467, 3.5472786537201078 ], [ -0.7744315313909276, 6.382106120396532, 5.848968366279892 ], [ -2.4815837513151306, 11.52410636938096, 4.140627869934377 ], [ -2.4815837513151306, 11.04068831561904, 5.2556191500656215 ], [ 2.4815837513151306, 8.81722106061904, 2.166888190065623 ], [ 2.4815837513151306, 9.30063911438096, 1.0518969099343773 ], [ -1.847823362097056, 11.411166587120755, 1.9441582797549755 ], [ -1.8478233620970559, 6.706693587879244, 1.2746268202450242 ], [ 1.8478233620970559, 8.930160842879244, 4.363357780245025 ], [ 1.847823362097056, 13.634633842120754, 5.032889239754976 ], [ 0.19615758742418787, 5.256941859183696, 2.5424566527700705 ], [ 0.19615758742418787, 12.860918315816303, 0.6763284472299296 ], [ -0.19615758742418787, 15.084385570816302, 3.7650594072299297 ], [ -0.19615758742418787, 7.480409114183696, 5.63118761277007 ], [ -0.8027292397322847, 14.845412421786872, 6.086167402785574 ], [ -0.8027292397322849, 7.719382263213129, 3.310079617214425 ], [ 0.8027292397322849, 5.495915008213128, 0.2213486572144253 ], [ 0.8027292397322847, 12.62194516678687, 2.997436442785575 ] ]
[{"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 ]
[ [ 0.06018374, 0, 0 ], [ 0, -1.28524747, -0.41985216 ], [ 0, -0.41985224, 0.04123109 ] ]
-146.982267
-158.502267
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00168715, 0.01556631, -0.03748896 ], [ -0.00168715, -0.01556631, 0.03748896 ], [ 0.00168715, -0.01556631, 0.03748896 ], [ 0.00168715, 0.01556631, -0.03748896 ], [ 0.00309788, 0.03166642, -0.05622548 ], [ 0.00309788, -0.03166642, 0.05622548 ], [ -0.00309788, -0.03166642, 0.05622548 ], [ -0.00309788, 0.03166642, -0.05622548 ], [ -0.02015557, 0.01020699, 0.02772281 ], [ -0.02015557, -0.01020699, -0.02772281 ], [ 0.02015557, -0.01020699, -0.02772281 ], [ 0.02015557, 0.01020699, 0.02772281 ], [ 0.00855573, -0.02346618, 0.00147796 ], [ 0.00855573, 0.02346618, -0.00147796 ], [ -0.00855573, 0.02346618, -0.00147796 ], [ -0.00855573, -0.02346618, 0.00147796 ], [ 0.02228948, -0.00187709, -0.00386242 ], [ 0.02228948, 0.00187709, 0.00386242 ], [ -0.02228948, 0.00187709, 0.00386242 ], [ -0.02228948, -0.00187709, -0.00386242 ] ]
pbe
true
15
agm005266151-pbe-426
426
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26191114, 7.94812981, 0.06592668 ], [ -3.26191114, 7.94812981, 0.06592668 ], [ 0, 4.44815423, 6.17768527 ] ]
agm005266151
[ [ 1.63095557, 3.974064905, 0.03296334 ], [ -1.63095557, 6.198142020000001, 3.1218059749999996 ], [ 0.7742053452513624, 4.15936430326621, 2.760405340359993 ], [ 0.7742053452513624, 13.960972431733788, 0.4602906546400067 ], [ -0.7742053452513624, 16.18504954673379, 3.549133289640007 ], [ -0.7742053452513624, 6.3834414182662105, 5.849247975359993 ], [ -2.4815711184676394, 11.52597068032198, 4.141696033356607 ], [ -2.4815711184676394, 11.042520284678021, 5.2566852316433925 ], [ 2.4815711184676394, 8.818443169678023, 2.1678425966433936 ], [ 2.4815711184676394, 9.30189356532198, 1.0528533983566064 ], [ -1.848038268038578, 11.412587197838334, 1.9453325390630753 ], [ -1.8480382680385776, 6.707749537161664, 1.2753634559369245 ], [ 1.8480382680385776, 8.931826652161664, 4.364206090936924 ], [ 1.848038268038578, 13.636664312838334, 5.034175174063075 ], [ 0.19607240219472366, 5.257634945955807, 2.5425281565071867 ], [ 0.19607240219472377, 12.862701789044193, 0.6781678384928131 ], [ -0.19607240219472377, 15.086778904044195, 3.7670104734928134 ], [ -0.19607240219472366, 7.481712060955807, 5.6313707915071864 ], [ -0.8018032663571146, 14.8484284095489, 6.087893081862476 ], [ -0.8018032663571147, 7.720062555451099, 3.3104881831375224 ], [ 0.8018032663571147, 5.495985440451099, 0.22164554813752307 ], [ 0.8018032663571146, 12.6243512945489, 2.9990504468624763 ] ]
[{"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 ]
[ [ 0.08885355, 0, 0 ], [ 0, -1.12590995, -0.44988485 ], [ 0, -0.44988493, 0.23244192 ] ]
-146.982354
-158.502354
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.002218, 0.01415633, -0.03619424 ], [ -0.002218, -0.01415633, 0.03619424 ], [ 0.002218, -0.01415633, 0.03619424 ], [ 0.002218, 0.01415633, -0.03619424 ], [ 0.00318306, 0.02960694, -0.0521561 ], [ 0.00318306, -0.02960694, 0.0521561 ], [ -0.00318306, -0.02960694, 0.0521561 ], [ -0.00318306, 0.02960694, -0.0521561 ], [ -0.01749298, 0.0080555, 0.02509357 ], [ -0.01749298, -0.0080555, -0.02509357 ], [ 0.01749298, -0.0080555, -0.02509357 ], [ 0.01749298, 0.0080555, 0.02509357 ], [ 0.00601432, -0.01962733, 0.00077984 ], [ 0.00601432, 0.01962733, -0.00077984 ], [ -0.00601432, 0.01962733, -0.00077984 ], [ -0.00601432, -0.01962733, 0.00077984 ], [ 0.02089547, -0.00214588, -0.00348771 ], [ 0.02089547, 0.00214588, 0.00348771 ], [ -0.02089547, 0.00214588, 0.00348771 ], [ -0.02089547, -0.00214588, -0.00348771 ] ]
pbe
true
15
agm005266151-pbe-427
427
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26116331, 7.95092985, 0.06862551 ], [ -3.26116331, 7.95092985, 0.06862551 ], [ 0, 4.45181337, 6.17835533 ] ]
agm005266151
[ [ 1.630581655, 3.975464925, 0.034312755 ], [ -1.630581655, 6.20137161, 3.12349042 ], [ 0.7735268700170175, 4.161540419542444, 2.760909147196422 ], [ 0.7735268700170175, 13.966225965457555, 0.465519537803578 ], [ -0.7735268700170175, 16.192132650457555, 3.554697202803578 ], [ -0.7735268700170175, 6.387447104542443, 5.850086812196422 ], [ -2.4815331076250517, 11.531563501225586, 4.1449005049598 ], [ -2.4815331076250513, 11.048016253774414, 5.2598835100402 ], [ 2.4815331076250513, 8.822109568774414, 2.1707058450402 ], [ 2.4815331076250517, 9.305656816225586, 1.0557228399597998 ], [ -1.8486827131951726, 11.416848784840544, 1.9488551612718668 ], [ -1.8486827131951733, 6.710917600159454, 1.2775735237281332 ], [ 1.8486827131951733, 8.936824285159455, 4.366751188728133 ], [ 1.8486827131951726, 13.642755469840544, 5.038032826271866 ], [ 0.19581697490018024, 5.259713618131156, 2.5427425532611156 ], [ 0.19581697490018035, 12.868052766868844, 0.6836861317388838 ], [ -0.19581697490018035, 15.093959451868844, 3.772863796738884 ], [ -0.19581697490018024, 7.485620303131155, 5.631920218261116 ], [ -0.7990260363844397, 14.857477391169041, 6.093070580070061 ], [ -0.7990260363844398, 7.722102363830958, 3.311713434929938 ], [ 0.7990260363844398, 5.496195678830958, 0.22253576992993812 ], [ 0.7990260363844397, 12.631570706169041, 3.0038929150700615 ] ]
[{"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 ]
[ [ 0.1749817, 0, 0 ], [ 0, -0.62685575, -0.52229281 ], [ 0, -0.52229293, 0.82612885 ] ]
-146.982562
-158.502562
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00349121, 0.0103637, -0.03184846 ], [ -0.00349121, -0.0103637, 0.03184846 ], [ 0.00349121, -0.0103637, 0.03184846 ], [ 0.00349121, 0.0103637, -0.03184846 ], [ 0.00363883, 0.02335425, -0.04010076 ], [ 0.00363883, -0.02335425, 0.04010076 ], [ -0.00363883, -0.02335425, 0.04010076 ], [ -0.00363883, 0.02335425, -0.04010076 ], [ -0.00956142, 0.001517, 0.01699799 ], [ -0.00956142, -0.001517, -0.01699799 ], [ 0.00956142, -0.001517, -0.01699799 ], [ 0.00956142, 0.001517, 0.01699799 ], [ -0.00195452, -0.00769749, -0.00115425 ], [ -0.00195452, 0.00769749, 0.00115425 ], [ 0.00195452, 0.00769749, 0.00115425 ], [ 0.00195452, -0.00769749, -0.00115425 ], [ 0.0180638, -0.00298532, -0.00190292 ], [ 0.0180638, 0.00298532, 0.00190292 ], [ -0.0180638, 0.00298532, 0.00190292 ], [ -0.0180638, -0.00298532, -0.00190292 ] ]
pbe
true
15
agm005266151-pbe-428
428
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25966767, 7.95652992, 0.07402317 ], [ -3.25966767, 7.95652992, 0.07402317 ], [ 0, 4.45913165, 6.17969544 ] ]
agm005266151
[ [ 1.629833835, 3.97826496, 0.037011585 ], [ -1.629833835, 6.2078307850000005, 3.126859305 ], [ 0.7721703528025073, 4.165891416684575, 2.761916754247067 ], [ 0.7721703528025077, 13.976734248315426, 0.4759773057529332 ], [ -0.7721703528025077, 16.206300073315425, 3.565825025752933 ], [ -0.7721703528025073, 6.395457241684575, 5.851764474247067 ], [ -2.4814565336681254, 11.542749127150339, 4.151309761059905 ], [ -2.481456533668125, 11.059008187849663, 5.266279738940095 ], [ 2.481456533668125, 8.829442362849663, 2.176432018940095 ], [ 2.4814565336681254, 9.313183302150339, 1.0614620410599052 ], [ -1.8499706341886213, 11.42537143338996, 1.9559000613967956 ], [ -1.8499706341886217, 6.71725423161004, 1.281993998603204 ], [ 1.8499706341886217, 8.94682005661004, 4.371841718603204 ], [ 1.8499706341886213, 13.65493725838996, 5.045747781396796 ], [ 0.19530628071239675, 5.263868295779802, 2.543171147773118 ], [ 0.19530628071239642, 12.8787573692202, 0.6947229122268819 ], [ -0.19530628071239642, 15.108323194220198, 3.784570632226882 ], [ -0.19530628071239675, 7.493434120779802, 5.633018867773118 ], [ -0.793473943456469, 14.875579280831165, 6.1034274359650595 ], [ -0.793473943456469, 7.726178034168832, 3.31416206403494 ], [ 0.793473943456469, 5.496612209168832, 0.22431434403494008 ], [ 0.793473943456469, 12.646013455831167, 3.0135797159650597 ] ]
[{"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 ]
[ [ 0.3420115, 0, 0 ], [ 0, 0.34583848, -0.68608703 ], [ 0, -0.68608701, 1.97937509 ] ]
-146.982745
-158.502745
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00595059, 0.00255912, -0.02372423 ], [ -0.00595059, -0.00255912, 0.02372423 ], [ 0.00595059, -0.00255912, 0.02372423 ], [ 0.00595059, 0.00255912, -0.02372423 ], [ 0.00448478, 0.01096966, -0.01601721 ], [ 0.00448478, -0.01096966, 0.01601721 ], [ -0.00448478, -0.01096966, 0.01601721 ], [ -0.00448478, 0.01096966, -0.01601721 ], [ 0.00581191, -0.01153564, 0.0015077 ], [ 0.00581191, 0.01153564, -0.0015077 ], [ -0.00581191, 0.01153564, -0.0015077 ], [ -0.00581191, -0.01153564, 0.0015077 ], [ -0.0176918, 0.01568335, -0.00503504 ], [ -0.0176918, -0.01568335, 0.00503504 ], [ 0.0176918, -0.01568335, 0.00503504 ], [ 0.0176918, 0.01568335, -0.00503504 ], [ 0.01204504, -0.00468198, 0.00100642 ], [ 0.01204504, 0.00468198, -0.00100642 ], [ -0.01204504, 0.00468198, -0.00100642 ], [ -0.01204504, -0.00468198, 0.00100642 ] ]
pbe
true
15
agm005266151-pbe-429
429
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.52923578, 7.16246064, -0.0308653 ], [ -3.52923578, 7.16246064, -0.0308653 ], [ 0, 3.94320259, 6.08987549 ] ]
agm005266151
[ [ 1.76461789, 3.58123032, -0.01543265 ], [ -1.76461789, 5.552831615, 3.0295050949999998 ], [ 0.7904318911386087, 3.748039229773356, 2.6806083241399974 ], [ 0.7904318911386086, 12.548483345226645, 0.3025988208600028 ], [ -0.7904318911386086, 14.520084640226644, 3.347536565860003 ], [ -0.7904318911386087, 5.7196405247733555, 5.725546069139997 ], [ -2.71279151537547, 10.354503463103374, 3.9770596629663864 ], [ -2.7127915153754705, 9.885221701896626, 5.096022972033613 ], [ 2.7127915153754705, 7.913620406896625, 2.051085227033613 ], [ 2.71279151537547, 8.382902168103374, 0.9321219179663868 ], [ -2.015663054031098, 10.257026856013109, 1.8050964548752284 ], [ -2.015663054031098, 6.03949571898689, 1.1781106901247713 ], [ 2.015663054031098, 8.01109701398689, 4.22304843512477 ], [ 2.015663054031098, 12.22862815101311, 4.850034199875228 ], [ 0.11888904808963996, 4.781069808839817, 2.4164713298226714 ], [ 0.11888904808963963, 11.515452766160182, 0.5667358151773288 ], [ -0.11888904808963963, 13.487054061160183, 3.611673560177329 ], [ -0.11888904808963996, 6.752671103839816, 5.4614090748226705 ], [ -1.0745738048062528, 13.098078918002823, 5.837260656873163 ], [ -1.0745738048062528, 7.141646246997176, 3.235821978126837 ], [ 1.0745738048062528, 5.170044951997176, 0.1908842331268375 ], [ 1.0745738048062528, 11.126477623002822, 2.7923229118731623 ] ]
[{"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 ]
[ [ 0.44160677, 0, 0 ], [ 0, -0.2548691, -0.13873567 ], [ 0, -0.13873562, 2.03906513 ] ]
-146.826471
-158.346471
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.04422443, -0.0163238, 0.00687718 ], [ 0.04422443, 0.0163238, -0.00687718 ], [ -0.04422443, 0.0163238, -0.00687718 ], [ -0.04422443, -0.0163238, 0.00687718 ], [ -0.00694684, 0.13143492, -0.2567978 ], [ -0.00694684, -0.13143492, 0.2567978 ], [ 0.00694684, -0.13143492, 0.2567978 ], [ 0.00694684, 0.13143492, -0.2567978 ], [ 0.02957585, -0.01099898, -0.00734184 ], [ 0.02957585, 0.01099898, 0.00734184 ], [ -0.02957585, 0.01099898, 0.00734184 ], [ -0.02957585, -0.01099898, -0.00734184 ], [ 0.01359019, -0.00747954, 0.07939144 ], [ 0.01359019, 0.00747954, -0.07939144 ], [ -0.01359019, 0.00747954, -0.07939144 ], [ -0.01359019, -0.00747954, 0.07939144 ], [ 0.02724556, 0.0295207, 0.00355615 ], [ 0.02724556, -0.0295207, -0.00355615 ], [ -0.02724556, -0.0295207, -0.00355615 ], [ -0.02724556, 0.0295207, 0.00355615 ] ]
pbe
true
15
agm005266151-pbe-43
43
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25955795, 7.95737153, 0.07433969 ], [ -3.25955795, 7.95737153, 0.07433969 ], [ 0, 4.45984233, 6.18042916 ] ]
agm005266151
[ [ 1.629778975, 3.978685765, 0.037169845 ], [ -1.629778975, 6.20860693, 3.1273844250000002 ], [ 0.771983078719083, 4.16640360142072, 2.7620370071553118 ], [ 0.7719830787190829, 13.978260623579281, 0.47685695284468843 ], [ -0.7719830787190829, 16.20818178857928, 3.5670715328446887 ], [ -0.771983078719083, 6.396324766420721, 5.852251587155312 ], [ -2.4814694258803516, 11.544240192423661, 4.151987526557878 ], [ -2.4814694258803516, 11.060266362576337, 5.267335593442121 ], [ 2.4814694258803516, 8.830345197576337, 2.1771210134421217 ], [ 2.4814694258803516, 9.314319027423661, 1.0617729465578782 ], [ -1.850124505699569, 11.426478942116269, 1.9565088099958179 ], [ -1.850124505699569, 6.718185282883731, 1.282385150004182 ], [ 1.850124505699569, 8.948106447883731, 4.372599730004182 ], [ 1.850124505699569, 13.65640010711627, 5.046723389995818 ], [ 0.19512701534758858, 5.264480730750376, 2.543277061797915 ], [ 0.19512701534758836, 12.880183494249623, 0.6956168982020847 ], [ -0.19512701534758836, 15.110104659249624, 3.785831478202085 ], [ -0.19512701534758858, 7.494401895750375, 5.6334916417979155 ], [ -0.7927418668838737, 14.87778099314493, 6.1047950920228224 ], [ -0.7927418668838735, 7.726725561855068, 3.314528027977177 ], [ 0.7927418668838735, 5.496804396855069, 0.22431344797717712 ], [ 0.7927418668838737, 12.64785982814493, 3.014580512022823 ] ]
[{"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 ]
[ [ 0.20954938, 0, 0 ], [ 0, -0.00207144, -0.42682555 ], [ 0, -0.42682559, 1.31926875 ] ]
-146.982839
-158.502839
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00770542, 0.00305136, -0.01800885 ], [ -0.00770542, -0.00305136, 0.01800885 ], [ 0.00770542, -0.00305136, 0.01800885 ], [ 0.00770542, 0.00305136, -0.01800885 ], [ 0.00416868, -0.00386166, 0.01739053 ], [ 0.00416868, 0.00386166, -0.01739053 ], [ -0.00416868, 0.00386166, -0.01739053 ], [ -0.00416868, -0.00386166, 0.01739053 ], [ 0.00522041, -0.0093224, 0.00002254 ], [ 0.00522041, 0.0093224, -0.00002254 ], [ -0.00522041, 0.0093224, -0.00002254 ], [ -0.00522041, -0.0093224, 0.00002254 ], [ -0.01525645, 0.01046892, -0.00487261 ], [ -0.01525645, -0.01046892, 0.00487261 ], [ 0.01525645, -0.01046892, 0.00487261 ], [ 0.01525645, 0.01046892, -0.00487261 ], [ 0.01005065, -0.00380594, 0.00106603 ], [ 0.01005065, 0.00380594, -0.00106603 ], [ -0.01005065, 0.00380594, -0.00106603 ], [ -0.01005065, -0.00380594, 0.00106603 ] ]
pbe
true
15
agm005266151-pbe-430
430
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25941515, 7.95846696, 0.07475167 ], [ -3.25941515, 7.95846696, 0.07475167 ], [ 0, 4.46076734, 6.18138415 ] ]
agm005266151
[ [ 1.629707575, 3.97923348, 0.037375835 ], [ -1.629707575, 6.20961715, 3.1280679100000004 ], [ 0.7717393195027996, 4.1670700540170875, 2.762193459143431 ], [ 0.7717393195027995, 13.980247535982912, 0.4780019558565691 ], [ -0.7717393195027995, 16.21063120598291, 3.568694030856569 ], [ -0.7717393195027996, 6.397453724017089, 5.852885534143431 ], [ -2.4814862011273506, 11.54618090868674, 4.152869723179286 ], [ -2.4814862011273506, 11.06190402131326, 5.268709841820714 ], [ 2.4814862011273506, 8.83152035131326, 2.1780177668207137 ], [ 2.4814862011273506, 9.31579723868674, 1.0621776481792866 ], [ -1.8503247725668697, 11.427920397088114, 1.9573011798933078 ], [ -1.8503247725668697, 6.719397192911885, 1.2828942351066925 ], [ 1.8503247725668697, 8.949780862911886, 4.373586310106693 ], [ 1.8503247725668697, 13.658304067088114, 5.047993254893308 ], [ 0.19489379542061513, 5.26527785464033, 2.543414888787278 ], [ 0.1948937954206147, 12.88203973535967, 0.6967805262127221 ], [ -0.1948937954206147, 15.11242340535967, 3.7874726012127224 ], [ -0.19489379542061513, 7.49566152464033, 5.634106963787278 ], [ -0.7917890576974491, 14.88064657991221, 6.106575156061942 ], [ -0.791789057697449, 7.727438350087791, 3.3150044089380577 ], [ 0.791789057697449, 5.497054680087792, 0.22431233393805744 ], [ 0.7917890576974491, 12.65026290991221, 3.0158830810619426 ] ]
[{"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 ]
[ [ 0.08096081, 0, 0 ], [ 0, -0.39191423, -0.08951694 ], [ 0, -0.08951697, 0.51532346 ] ]
-146.982888
-158.502888
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00988491, 0.00385878, -0.01023621 ], [ -0.00988491, -0.00385878, 0.01023621 ], [ 0.00988491, -0.00385878, 0.01023621 ], [ 0.00988491, 0.00385878, -0.01023621 ], [ 0.00384545, -0.02309549, 0.06086093 ], [ 0.00384545, 0.02309549, -0.06086093 ], [ -0.00384545, 0.02309549, -0.06086093 ], [ -0.00384545, -0.02309549, 0.06086093 ], [ 0.00444179, -0.00620386, -0.00260216 ], [ 0.00444179, 0.00620386, 0.00260216 ], [ -0.00444179, 0.00620386, 0.00260216 ], [ -0.00444179, -0.00620386, -0.00260216 ], [ -0.0125014, 0.00401414, -0.00476451 ], [ -0.0125014, -0.00401414, 0.00476451 ], [ 0.0125014, -0.00401414, 0.00476451 ], [ 0.0125014, 0.00401414, -0.00476451 ], [ 0.00784252, -0.00111006, 0.00136313 ], [ 0.00784252, 0.00111006, -0.00136313 ], [ -0.00784252, 0.00111006, -0.00136313 ], [ -0.00784252, -0.00111006, 0.00136313 ] ]
pbe
true
15
agm005266151-pbe-431
431
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25932609, 7.95909566, 0.07501309 ], [ -3.25932609, 7.95909566, 0.07501309 ], [ 0, 4.46131506, 6.182206 ] ]
agm005266151
[ [ 1.629663045, 3.97954783, 0.037506545 ], [ -1.629663045, 6.21020536, 3.1286095449999998 ], [ 0.7715137098469422, 4.167474996193124, 2.7623013875783595 ], [ 0.7715137098469422, 13.981373853806879, 0.47882779242164086 ], [ -0.7715137098469422, 16.212031383806877, 3.569930792421641 ], [ -0.7715137098469422, 6.398132526193124, 5.853404387578359 ], [ -2.481487006010195, 11.54719967201207, 4.153890633615444 ], [ -2.4814870060101946, 11.06296423798793, 5.269444546384555 ], [ 2.4814870060101946, 8.83230670798793, 2.178341546384556 ], [ 2.481487006010195, 9.31654214201207, 1.062787633615444 ], [ -1.8504510654737754, 11.428686909660804, 1.9578532861038274 ], [ -1.8504510654737751, 6.720161940339194, 1.2832758938961728 ], [ 1.8504510654737751, 8.950819470339194, 4.374378893896172 ], [ 1.8504510654737754, 13.659344439660805, 5.048956286103827 ], [ 0.1946589810080721, 5.265756530210325, 2.5435290324989017 ], [ 0.1946589810080721, 12.883092319789675, 0.6976001475010983 ], [ -0.1946589810080721, 15.113749849789675, 3.788703147501098 ], [ -0.1946589810080721, 7.496414060210326, 5.634632032498901 ], [ -0.7910674500452013, 14.882374645161917, 6.107946836097345 ], [ -0.791067450045201, 7.7277892648380835, 3.3153883439026552 ], [ 0.791067450045201, 5.497131734838083, 0.2242853439026548 ], [ 0.7910674500452013, 12.651717115161919, 3.0168438360973453 ] ]
[{"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 ]
[ [ -0.05222914, 0, 0 ], [ 0, -0.69143117, -0.01970127 ], [ 0, -0.0197013, 0.18721004 ] ]
-146.982968
-158.502968
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00976843, -0.0011782, 0.00458114 ], [ -0.00976843, 0.0011782, -0.00458114 ], [ 0.00976843, 0.0011782, -0.00458114 ], [ 0.00976843, -0.0011782, 0.00458114 ], [ 0.00332061, -0.00580426, 0.01994599 ], [ 0.00332061, 0.00580426, -0.01994599 ], [ -0.00332061, 0.00580426, -0.01994599 ], [ -0.00332061, -0.00580426, 0.01994599 ], [ 0.00138561, -0.00167162, -0.00143523 ], [ 0.00138561, 0.00167162, 0.00143523 ], [ -0.00138561, 0.00167162, 0.00143523 ], [ -0.00138561, -0.00167162, -0.00143523 ], [ -0.00946136, -0.00285854, -0.00433096 ], [ -0.00946136, 0.00285854, 0.00433096 ], [ 0.00946136, 0.00285854, 0.00433096 ], [ 0.00946136, -0.00285854, -0.00433096 ], [ 0.00594532, 0.0004619, 0.00144476 ], [ 0.00594532, -0.0004619, -0.00144476 ], [ -0.00594532, -0.0004619, -0.00144476 ], [ -0.00594532, 0.0004619, 0.00144476 ] ]
pbe
true
15
agm005266151-pbe-432
432
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25927696, 7.95944255, 0.07515733 ], [ -3.25927696, 7.95944255, 0.07515733 ], [ 0, 4.46161727, 6.18265947 ] ]
agm005266151
[ [ 1.62963848, 3.979721275, 0.037578665 ], [ -1.62963848, 6.21052991, 3.1289084 ], [ 0.7713892115441521, 4.167698327062617, 2.7623609583624282 ], [ 0.7713892115441516, 13.981995407937385, 0.4792834366375721 ], [ -0.7713892115441516, 16.212804042937385, 3.5706131716375724 ], [ -0.7713892115441521, 6.398506962062617, 5.853690693362427 ], [ -2.481487506289496, 11.547761777256023, 4.154453948957292 ], [ -2.4814875062894957, 11.063549227743977, 5.269849916042709 ], [ 2.4814875062894957, 8.832740592743978, 2.178520181042708 ], [ 2.481487506289496, 9.316953142256024, 1.0631242139572916 ], [ -1.8505207551405967, 11.429109754998503, 1.958157909054657 ], [ -1.8505207551405967, 6.720583980001497, 1.2834864859453428 ], [ 1.8505207551405967, 8.951392615001497, 4.374816220945342 ], [ 1.8505207551405967, 13.659918389998502, 5.049487644054657 ], [ 0.19452939128051683, 5.26602068410092, 2.5435920564137344 ], [ 0.19452939128051705, 12.883673050899082, 0.698052338586265 ], [ -0.19452939128051705, 15.114481685899081, 3.7893820735862653 ], [ -0.19452939128051683, 7.49682931910092, 5.634921791413735 ], [ -0.7906693340299535, 14.883327987933779, 6.108703641072498 ], [ -0.7906693340299534, 7.727983017066222, 3.3156002239275018 ], [ 0.7906693340299534, 5.4971743820662216, 0.22427048892750107 ], [ 0.7906693340299535, 12.65251935293378, 3.017373906072499 ] ]
[{"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 ]
[ [ -0.11018925, 0, 0 ], [ 0, -0.8397698, 0.01746546 ], [ 0, 0.01746547, 0.02648421 ] ]
-146.982983
-158.502983
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00973318, -0.00383045, 0.01268589 ], [ -0.00973318, 0.00383045, -0.01268589 ], [ 0.00973318, 0.00383045, -0.01268589 ], [ 0.00973318, -0.00383045, 0.01268589 ], [ 0.00299774, 0.00385963, -0.00290566 ], [ 0.00299774, -0.00385963, 0.00290566 ], [ -0.00299774, -0.00385963, 0.00290566 ], [ -0.00299774, 0.00385963, -0.00290566 ], [ -0.0004109, 0.00101764, -0.0009856 ], [ -0.0004109, -0.00101764, 0.0009856 ], [ 0.0004109, -0.00101764, 0.0009856 ], [ 0.0004109, 0.00101764, -0.0009856 ], [ -0.00790807, -0.00672735, -0.00403562 ], [ -0.00790807, 0.00672735, 0.00403562 ], [ 0.00790807, 0.00672735, 0.00403562 ], [ 0.00790807, -0.00672735, -0.00403562 ], [ 0.00466022, 0.00163353, 0.00143698 ], [ 0.00466022, -0.00163353, -0.00143698 ], [ -0.00466022, -0.00163353, -0.00143698 ], [ -0.00466022, 0.00163353, 0.00143698 ] ]
pbe
true
15
agm005266151-pbe-433
433
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25926976, 7.9594934, 0.07517847 ], [ -3.25926976, 7.9594934, 0.07517847 ], [ 0, 4.46166156, 6.18272593 ] ]
agm005266151
[ [ 1.62963488, 3.9797467, 0.037589235 ], [ -1.62963488, 6.2105774799999995, 3.1289522 ], [ 0.7713709829868287, 4.167731020839932, 2.762369646834019 ], [ 0.7713709829868289, 13.982086559160068, 0.4793502581659811 ], [ -0.7713709829868289, 16.212917339160068, 3.5707132231659817 ], [ -0.7713709829868287, 6.398561800839932, 5.853732611834019 ], [ -2.481487565246368, 11.547844180225358, 4.154536545616671 ], [ -2.4814875652463675, 11.06363495977464, 5.269909289383329 ], [ 2.4814875652463675, 8.83280417977464, 2.178546324383329 ], [ 2.481487565246368, 9.31701340022536, 1.0631735806166707 ], [ -1.8505310079811645, 11.429171728683073, 1.9582025436279136 ], [ -1.850531007981165, 6.720645851316928, 1.2835173613720863 ], [ 1.850531007981165, 8.951476631316929, 4.374880326372086 ], [ 1.8505310079811645, 13.660002508683071, 5.049565508627914 ], [ 0.19451041630480637, 5.266059378690398, 2.5436012516949287 ], [ 0.19451041630480637, 12.883758201309602, 0.6981186533050714 ], [ -0.19451041630480637, 15.114588981309602, 3.7894816183050715 ], [ -0.19451041630480637, 7.496890158690398, 5.634964216694929 ], [ -0.7906109412705731, 14.883467770007375, 6.1088145784561965 ], [ -0.7906109412705727, 7.728011369992625, 3.315631256543804 ], [ 0.7906109412705727, 5.497180589992626, 0.2242682915438039 ], [ 0.7906109412705731, 12.652636990007375, 3.0174516134561964 ] ]
[{"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 ]
[ [ -0.11434947, 0, 0 ], [ 0, -0.85788397, 0.0210316 ], [ 0, 0.02103156, 0.01079156 ] ]
-146.982983
-158.502983
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00954327, -0.00417967, 0.01391939 ], [ -0.00954327, 0.00417967, -0.01391939 ], [ 0.00954327, 0.00417967, -0.01391939 ], [ 0.00954327, -0.00417967, 0.01391939 ], [ 0.00301093, 0.0052716, -0.00617411 ], [ 0.00301093, -0.0052716, 0.00617411 ], [ -0.00301093, -0.0052716, 0.00617411 ], [ -0.00301093, 0.0052716, -0.00617411 ], [ -0.00079799, 0.0012355, -0.00077288 ], [ -0.00079799, -0.0012355, 0.00077288 ], [ 0.00079799, -0.0012355, 0.00077288 ], [ 0.00079799, 0.0012355, -0.00077288 ], [ -0.00771783, -0.00737859, -0.00427169 ], [ -0.00771783, 0.00737859, 0.00427169 ], [ 0.00771783, 0.00737859, 0.00427169 ], [ 0.00771783, -0.00737859, -0.00427169 ], [ 0.00580329, 0.00230504, 0.0017815 ], [ 0.00580329, -0.00230504, -0.0017815 ], [ -0.00580329, -0.00230504, -0.0017815 ], [ -0.00580329, 0.00230504, 0.0017815 ] ]
pbe
true
15
agm005266151-pbe-434
434
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25925535, 7.95959509, 0.07522075 ], [ -3.25925535, 7.95959509, 0.07522075 ], [ 0, 4.46175015, 6.18285887 ] ]
agm005266151
[ [ 1.629627675, 3.979797545, 0.037610375 ], [ -1.629627675, 6.21067262, 3.1290398099999996 ], [ 0.7713344911320554, 4.167796578463481, 2.76238715562166 ], [ 0.7713344911320559, 13.982268676536519, 0.47948377937833997 ], [ -0.7713344911320559, 16.21314375153652, 3.57091321437834 ], [ -0.7713344911320554, 6.398671653463481, 5.853816590621659 ], [ -2.481487708065561, 11.548009017093658, 4.154701691858993 ], [ -2.481487708065561, 11.063806387906341, 5.270028113141006 ], [ 2.481487708065561, 8.832931312906341, 2.178598678141006 ], [ 2.481487708065561, 9.317133942093658, 1.0632722568589936 ], [ -1.8505514100167253, 11.42929563077991, 1.9582918795171989 ], [ -1.8505514100167246, 6.72076962422009, 1.2835790554828008 ], [ 1.8505514100167246, 8.95164469922009, 4.3750084904828 ], [ 1.8505514100167253, 13.66017070577991, 5.049721314517199 ], [ 0.194472466002516, 5.266136856358041, 2.543619772576782 ], [ 0.19447246600251633, 12.88392839864196, 0.6982511624232179 ], [ -0.19447246600251633, 15.11480347364196, 3.789680597423218 ], [ -0.194472466002516, 7.49701193135804, 5.635049207576781 ], [ -0.7904942518549052, 14.883747207813263, 6.109036411512683 ], [ -0.7904942518549049, 7.728068197186737, 3.315693393487316 ], [ 0.7904942518549049, 5.497193122186737, 0.2242639584873165 ], [ 0.7904942518549052, 12.652872132813263, 3.0176069765126834 ] ]
[{"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 ]
[ [ -0.14038065, 0, 0 ], [ 0, -0.90383007, 0.0328608 ], [ 0, 0.03286078, -0.04524503 ] ]
-146.982983
-158.502983
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00954958, -0.00524922, 0.01625036 ], [ -0.00954958, 0.00524922, -0.01625036 ], [ 0.00954958, 0.00524922, -0.01625036 ], [ 0.00954958, -0.00524922, 0.01625036 ], [ 0.00285166, 0.00798096, -0.01282737 ], [ 0.00285166, -0.00798096, 0.01282737 ], [ -0.00285166, -0.00798096, 0.01282737 ], [ -0.00285166, 0.00798096, -0.01282737 ], [ -0.00118085, 0.00196844, -0.00060449 ], [ -0.00118085, -0.00196844, 0.00060449 ], [ 0.00118085, -0.00196844, 0.00060449 ], [ 0.00118085, 0.00196844, -0.00060449 ], [ -0.00731539, -0.00832315, -0.00432095 ], [ -0.00731539, 0.00832315, 0.00432095 ], [ 0.00731539, 0.00832315, 0.00432095 ], [ 0.00731539, -0.00832315, -0.00432095 ], [ 0.00531379, 0.00251571, 0.00172232 ], [ 0.00531379, -0.00251571, -0.00172232 ], [ -0.00531379, -0.00251571, -0.00172232 ], [ -0.00531379, 0.00251571, 0.00172232 ] ]
pbe
true
15
agm005266151-pbe-435
435
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25926315, 7.95954006, 0.07519787 ], [ -3.25926315, 7.95954006, 0.07519787 ], [ 0, 4.46170222, 6.18278693 ] ]
agm005266151
[ [ 1.629631575, 3.97977003, 0.037598935 ], [ -1.629631575, 6.210621140000001, 3.1289924 ], [ 0.7713542630252744, 4.16776117043919, 2.762377709157553 ], [ 0.7713542630252745, 13.98217005956081, 0.4794114958424468 ], [ -0.7713542630252745, 16.21302116956081, 3.5708049608424464 ], [ -0.7713542630252744, 6.39861228043919, 5.853771174157553 ], [ -2.481487617087122, 11.547919792910909, 4.154612313893023 ], [ -2.481487617087122, 11.063713657089092, 5.269963821106978 ], [ 2.481487617087122, 8.832862547089093, 2.178570356106978 ], [ 2.481487617087122, 9.317068682910909, 1.063218848893022 ], [ -1.8505403572280625, 11.429228547779466, 1.9582435243079863 ], [ -1.8505403572280628, 6.720702682220535, 1.2835456806920134 ], [ 1.8505403572280628, 8.951553792220537, 4.3749391456920135 ], [ 1.8505403572280625, 13.660079657779466, 5.049636989307986 ], [ 0.19449300847204798, 5.2660949191358934, 2.543609747314833 ], [ 0.19449300847204842, 12.883836310864108, 0.698179457685167 ], [ -0.19449300847204842, 15.114687420864108, 3.7895729226851667 ], [ -0.19449300847204798, 7.496946029135893, 5.6350032123148335 ], [ -0.7905573852082333, 14.883595968766858, 6.108916406484199 ], [ -0.7905573852082335, 7.728037481233143, 3.315659728515801 ], [ 0.7905573852082335, 5.497186371233142, 0.2242662635158007 ], [ 0.7905573852082333, 12.652744858766859, 3.0175229414841986 ] ]
[{"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 ]
[ [ -0.11231103, 0, 0 ], [ 0, -0.85902712, 0.02616537 ], [ 0, 0.02616535, 0.00994732 ] ]
-146.982983
-158.502983
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.009712, -0.00486308, 0.01486142 ], [ -0.009712, 0.00486308, -0.01486142 ], [ 0.009712, 0.00486308, -0.01486142 ], [ 0.009712, -0.00486308, 0.01486142 ], [ 0.00280686, 0.00663971, -0.00965476 ], [ 0.00280686, -0.00663971, 0.00965476 ], [ -0.00280686, -0.00663971, 0.00965476 ], [ -0.00280686, 0.00663971, -0.00965476 ], [ -0.00167758, 0.0016142, -0.00120368 ], [ -0.00167758, -0.0016142, 0.00120368 ], [ 0.00167758, -0.0016142, 0.00120368 ], [ 0.00167758, 0.0016142, -0.00120368 ], [ -0.00810817, -0.00855106, -0.00472629 ], [ -0.00810817, 0.00855106, 0.00472629 ], [ 0.00810817, 0.00855106, 0.00472629 ], [ 0.00810817, -0.00855106, -0.00472629 ], [ 0.00502923, 0.00299411, 0.00190369 ], [ 0.00502923, -0.00299411, -0.00190369 ], [ -0.00502923, -0.00299411, -0.00190369 ], [ -0.00502923, 0.00299411, 0.00190369 ] ]
pbe
true
15
agm005266151-pbe-436
436
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25921039, 7.95937836, 0.07530368 ], [ -3.25921039, 7.95937836, 0.07530368 ], [ 0, 4.46169088, 6.18309239 ] ]
agm005266151
[ [ 1.629605195, 3.97968918, 0.03765184 ], [ -1.629605195, 6.21053462, 3.129198035 ], [ 0.771207366731256, 4.167677194168272, 2.7625174984173437 ], [ 0.7712073667312564, 13.981924965831725, 0.47963605658265623 ], [ -0.7712073667312564, 16.212770405831726, 3.5711822515826563 ], [ -0.771207366731256, 6.398522634168272, 5.854063693417343 ], [ -2.481454519976844, 11.54777124075092, 4.154938136283408 ], [ -2.481454519976844, 11.06352179924908, 5.270307808716591 ], [ 2.481454519976844, 8.83267635924908, 2.178761613716592 ], [ 2.481454519976844, 9.31692580075092, 1.0633919412834079 ], [ -1.850584450481273, 11.428960292642703, 1.9584524791012292 ], [ -1.8505844504812732, 6.720641867357297, 1.2837010758987706 ], [ 1.8505844504812732, 8.951487307357297, 4.375247270898771 ], [ 1.850584450481273, 13.659805732642704, 5.0499986741012295 ], [ 0.1943565257789739, 5.265960553444808, 2.543630422903898 ], [ 0.1943565257789741, 12.88364160655519, 0.6985231320961018 ], [ -0.1943565257789741, 15.11448704655519, 3.7900693270961017 ], [ -0.1943565257789739, 7.496805993444808, 5.635176617903898 ], [ -0.7902615580658976, 14.883519726817465, 6.109446779500616 ], [ -0.7902615580658974, 7.727773313182533, 3.3157991654993837 ], [ 0.7902615580658974, 5.496927873182533, 0.22425297049938359 ], [ 0.7902615580658976, 12.652674286817465, 3.017900584500616 ] ]
[{"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 ]
[ [ -0.13251822, 0, 0 ], [ 0, -0.84590826, 0.03801372 ], [ 0, 0.03801363, -0.16713947 ] ]
-146.983006
-158.503006
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00693566, -0.0070284, 0.01345009 ], [ -0.00693566, 0.0070284, -0.01345009 ], [ 0.00693566, 0.0070284, -0.01345009 ], [ 0.00693566, -0.0070284, 0.01345009 ], [ 0.00271627, 0.00539108, -0.00782809 ], [ 0.00271627, -0.00539108, 0.00782809 ], [ -0.00271627, -0.00539108, 0.00782809 ], [ -0.00271627, 0.00539108, -0.00782809 ], [ -0.00224674, 0.00262039, 0.00139034 ], [ -0.00224674, -0.00262039, -0.00139034 ], [ 0.00224674, -0.00262039, -0.00139034 ], [ 0.00224674, 0.00262039, 0.00139034 ], [ -0.00847689, -0.007101, -0.0036485 ], [ -0.00847689, 0.007101, 0.0036485 ], [ 0.00847689, 0.007101, 0.0036485 ], [ 0.00847689, -0.007101, -0.0036485 ], [ 0.00474086, 0.00127591, 0.00158352 ], [ 0.00474086, -0.00127591, -0.00158352 ], [ -0.00474086, -0.00127591, -0.00158352 ], [ -0.00474086, 0.00127591, 0.00158352 ] ]
pbe
true
15
agm005266151-pbe-437
437
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25905213, 7.95889326, 0.0756211 ], [ -3.25905213, 7.95889326, 0.0756211 ], [ 0, 4.46165686, 6.18400875 ] ]
agm005266151
[ [ 1.629526065, 3.97944663, 0.03781055 ], [ -1.629526065, 6.21027506, 3.1298149250000002 ], [ 0.7707666760985539, 4.16742534956089, 2.7629368380788573 ], [ 0.7707666760985536, 13.98118960043911, 0.48030973692114254 ], [ -0.7707666760985536, 16.21201803043911, 3.572314111921143 ], [ -0.7707666760985539, 6.39825377956089, 5.854941213078858 ], [ -2.481355177318565, 11.547325373758452, 4.155915526228654 ], [ -2.481355177318565, 11.062946436241546, 5.271339798771347 ], [ 2.481355177318565, 8.832118006241547, 2.1793354237713465 ], [ 2.481355177318565, 9.316496943758452, 1.0639111512286534 ], [ -1.8507168249853758, 11.428155415075544, 1.959079244648054 ], [ -1.8507168249853758, 6.720459534924457, 1.284167330351946 ], [ 1.8507168249853758, 8.951287964924457, 4.376171705351946 ], [ 1.8507168249853758, 13.658983845075543, 5.051083619648055 ], [ 0.19394713738141778, 5.265557482822739, 2.543692295080574 ], [ 0.19394713738141744, 12.88305746717726, 0.6995542799194265 ], [ -0.19394713738141744, 15.113885897177258, 3.7915586549194265 ], [ -0.19394713738141778, 7.496385912822739, 5.6356966700805735 ], [ -0.7893740712821824, 14.883290908925074, 6.111038055991476 ], [ -0.7893740712821823, 7.726980901074928, 3.3162172690085243 ], [ 0.7893740712821823, 5.496152471074927, 0.224212894008524 ], [ 0.7893740712821824, 12.652462478925074, 3.019033680991476 ] ]
[{"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 ]
[ [ -0.1485471, 0, 0 ], [ 0, -0.74130959, 0.07535648 ], [ 0, 0.0753564, -0.60870989 ] ]
-146.983058
-158.503058
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00140883, -0.01383091, 0.00889977 ], [ 0.00140883, 0.01383091, -0.00889977 ], [ -0.00140883, 0.01383091, -0.00889977 ], [ -0.00140883, -0.01383091, 0.00889977 ], [ 0.00203, 0.0019168, -0.00334587 ], [ 0.00203, -0.0019168, 0.00334587 ], [ -0.00203, -0.0019168, 0.00334587 ], [ -0.00203, 0.0019168, -0.00334587 ], [ -0.0061766, 0.0052684, 0.00728532 ], [ -0.0061766, -0.0052684, -0.00728532 ], [ 0.0061766, -0.0052684, -0.00728532 ], [ 0.0061766, 0.0052684, 0.00728532 ], [ -0.01156903, -0.00502912, -0.002096 ], [ -0.01156903, 0.00502912, 0.002096 ], [ 0.01156903, 0.00502912, 0.002096 ], [ 0.01156903, -0.00502912, -0.002096 ], [ 0.00450223, -0.00069029, 0.00179568 ], [ 0.00450223, 0.00069029, -0.00179568 ], [ -0.00450223, 0.00069029, -0.00179568 ], [ -0.00450223, -0.00069029, 0.00179568 ] ]
pbe
true
15
agm005266151-pbe-438
438
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25873562, 7.95792306, 0.07625594 ], [ -3.25873562, 7.95792306, 0.07625594 ], [ 0, 4.46158883, 6.18584148 ] ]
agm005266151
[ [ 1.62936781, 3.97896153, 0.03812797 ], [ -1.62936781, 6.2097559449999995, 3.13104871 ], [ 0.7698853820973798, 4.166921650561653, 2.7637755053042805 ], [ 0.7698853820973799, 13.979718884438347, 0.48165711469571937 ], [ -0.7698853820973799, 16.210513299438347, 3.5745778546957188 ], [ -0.7698853820973798, 6.397716065561653, 5.85669624530428 ], [ -2.4811565260405812, 11.546433581227383, 4.157870419241784 ], [ -2.4811565260405812, 11.061795783772615, 5.273403680758216 ], [ 2.4811565260405812, 8.831001368772615, 2.180482940758216 ], [ 2.4811565260405812, 9.315639166227383, 1.0649496792417839 ], [ -1.8509814823357884, 11.426545682240715, 1.9603327608456849 ], [ -1.8509814823357886, 6.720094852759285, 1.285099859154315 ], [ 1.8509814823357886, 8.950889267759285, 4.378020599154315 ], [ 1.8509814823357884, 13.657340097240715, 5.053253500845686 ], [ 0.19312844512160088, 5.264751157759135, 2.5438158001852296 ], [ 0.1931284451216011, 12.881889377240864, 0.7016168198147701 ], [ -0.1931284451216011, 15.112683792240864, 3.7945375598147697 ], [ -0.19312844512160088, 7.495545572759136, 5.63673654018523 ], [ -0.787599249767932, 14.882833332973469, 6.114220803172403 ], [ -0.7875992497679318, 7.7253960320265325, 3.3170532968275963 ], [ 0.7875992497679318, 5.494601617026532, 0.22413255682759675 ], [ 0.787599249767932, 12.652038917973469, 3.021300063172403 ] ]
[{"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 ]
[ [ -0.17746383, 0, 0 ], [ 0, -0.536171, 0.14858675 ], [ 0, 0.14858671, -1.49203223 ] ]
-146.983091
-158.503091
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01819317, -0.02771714, -0.00027299 ], [ 0.01819317, 0.02771714, 0.00027299 ], [ -0.01819317, 0.02771714, 0.00027299 ], [ -0.01819317, -0.02771714, -0.00027299 ], [ 0.00071499, -0.00511058, 0.00554455 ], [ 0.00071499, 0.00511058, -0.00554455 ], [ -0.00071499, 0.00511058, -0.00554455 ], [ -0.00071499, -0.00511058, 0.00554455 ], [ -0.01409398, 0.01070826, 0.01957456 ], [ -0.01409398, -0.01070826, -0.01957456 ], [ 0.01409398, -0.01070826, -0.01957456 ], [ 0.01409398, 0.01070826, 0.01957456 ], [ -0.01767315, -0.00109024, 0.00090629 ], [ -0.01767315, 0.00109024, -0.00090629 ], [ 0.01767315, 0.00109024, -0.00090629 ], [ 0.01767315, -0.00109024, 0.00090629 ], [ 0.0040588, -0.00493683, 0.00213499 ], [ 0.0040588, 0.00493683, -0.00213499 ], [ -0.0040588, 0.00493683, -0.00213499 ], [ -0.0040588, -0.00493683, 0.00213499 ] ]
pbe
true
15
agm005266151-pbe-439
439
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.52400618, 7.16475936, -0.03458726 ], [ -3.52400618, 7.16475936, -0.03458726 ], [ 0, 3.94128697, 6.08603462 ] ]
agm005266151
[ [ 1.76200309, 3.58237968, -0.01729363 ], [ -1.76200309, 5.553023165, 3.02572368 ], [ 0.7911498889484165, 3.7474375365624004, 2.6789990124949887 ], [ 0.7911498889484165, 12.5527246684376, 0.29484377750501106 ], [ -0.7911498889484165, 14.5233681534376, 3.337861087505011 ], [ -0.7911498889484165, 5.7180810215624005, 5.72201632249499 ], [ -2.708699369647931, 10.354852243583185, 3.969788321171784 ], [ -2.708699369647931, 9.886596931416815, 5.090089088828216 ], [ 2.708699369647931, 7.915953446416815, 2.0470717788282156 ], [ 2.708699369647931, 8.384208758583185, 0.9267710111717844 ], [ -2.0116570437746226, 10.259710938810043, 1.7974732421473054 ], [ -2.0116570437746226, 6.040451266189957, 1.1763695478526948 ], [ 2.0116570437746226, 8.011094751189956, 4.219386857852695 ], [ 2.0116570437746226, 12.230354423810043, 4.840490552147306 ], [ 0.12104400911317381, 4.781727564581532, 2.416397468359926 ], [ 0.12104400911317414, 11.51843464041847, 0.5574453216400742 ], [ -0.12104400911317414, 13.48907812541847, 3.600462631640074 ], [ -0.12104400911317381, 6.752371049581532, 5.4594147783599265 ], [ -1.069377083911529, 13.101511662006384, 5.826275615822696 ], [ -1.069377083911529, 7.139937512993614, 3.233601794177304 ], [ 1.069377083911529, 5.1692940279936135, 0.19058448417730442 ], [ 1.069377083911529, 11.130868177006384, 2.7832583058226956 ] ]
[{"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 ]
[ [ 1.1808692, 0, 0 ], [ 0, 1.04524784, -0.23362956 ], [ 0, -0.23362957, 2.97253338 ] ]
-146.828338
-158.348338
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.03480264, -0.00640122, -0.03399372 ], [ 0.03480264, 0.00640122, 0.03399372 ], [ -0.03480264, 0.00640122, 0.03399372 ], [ -0.03480264, -0.00640122, -0.03399372 ], [ 0.00233461, 0.0879125, -0.1486497 ], [ 0.00233461, -0.0879125, 0.1486497 ], [ -0.00233461, -0.0879125, 0.1486497 ], [ -0.00233461, 0.0879125, -0.1486497 ], [ 0.03913166, -0.02837515, 0.01706665 ], [ 0.03913166, 0.02837515, -0.01706665 ], [ -0.03913166, 0.02837515, -0.01706665 ], [ -0.03913166, -0.02837515, 0.01706665 ], [ 0.01074781, 0.00258949, 0.07846086 ], [ 0.01074781, -0.00258949, -0.07846086 ], [ -0.01074781, -0.00258949, -0.07846086 ], [ -0.01074781, 0.00258949, 0.07846086 ], [ 0.02775793, 0.01349738, 0.00405365 ], [ 0.02775793, -0.01349738, -0.00405365 ], [ -0.02775793, -0.01349738, -0.00405365 ], [ -0.02775793, 0.01349738, 0.00405365 ] ]
pbe
true
15
agm005266151-pbe-44
44
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25868015, 7.95771258, 0.07636573 ], [ -3.25868015, 7.95771258, 0.07636573 ], [ 0, 4.46155495, 6.18596849 ] ]
agm005266151
[ [ 1.629340075, 3.97885629, 0.038182865 ], [ -1.629340075, 6.2096337649999995, 3.13116711 ], [ 0.7697878121656304, 4.166768597410941, 2.7638398696321858 ], [ 0.7697878121656303, 13.979434037589058, 0.4818758353678139 ], [ -0.7697878121656303, 16.21021151258906, 3.574860080367814 ], [ -0.7697878121656304, 6.397546072410941, 5.856824114632186 ], [ -2.481119179964964, 11.546203815097662, 4.1580916495623885 ], [ -2.481119179964964, 11.061553769902336, 5.273592545437611 ], [ 2.481119179964964, 8.830776294902336, 2.180608300437611 ], [ 2.481119179964964, 9.315426340097662, 1.0651074045623885 ], [ -1.8510400449606503, 11.42623573236709, 1.9605304499220544 ], [ -1.85104004496065, 6.719966902632908, 1.2851852550779455 ], [ 1.85104004496065, 8.950744377632908, 4.378169500077945 ], [ 1.8510400449606503, 13.65701320736709, 5.053514694922055 ], [ 0.19297688775410105, 5.264592138492568, 2.5437863383585677 ], [ 0.19297688775410116, 12.881610496507431, 0.7019293666414319 ], [ -0.19297688775410116, 15.112387971507431, 3.7949136116414315 ], [ -0.19297688775410105, 7.495369613492568, 5.636770583358567 ], [ -0.7873315033155823, 14.882642676033594, 6.1145750850716505 ], [ -0.7873315033155823, 7.725114908966407, 3.317109109928349 ], [ 0.7873315033155823, 5.494337433966407, 0.2241248649283495 ], [ 0.7873315033155823, 12.651865201033594, 3.0215908400716502 ] ]
[{"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 ]
[ [ -0.15499758, 0, 0 ], [ 0, -0.48960215, 0.1623343 ], [ 0, 0.16233433, -1.44192953 ] ]
-146.983113
-158.503113
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01729979, -0.0253196, -0.00010345 ], [ 0.01729979, 0.0253196, 0.00010345 ], [ -0.01729979, 0.0253196, 0.00010345 ], [ -0.01729979, -0.0253196, -0.00010345 ], [ 0.00056543, -0.00447892, 0.00360388 ], [ 0.00056543, 0.00447892, -0.00360388 ], [ -0.00056543, 0.00447892, -0.00360388 ], [ -0.00056543, -0.00447892, 0.00360388 ], [ -0.01301242, 0.00931996, 0.01874071 ], [ -0.01301242, -0.00931996, -0.01874071 ], [ 0.01301242, -0.00931996, -0.01874071 ], [ 0.01301242, 0.00931996, 0.01874071 ], [ -0.01756354, -0.00207241, 0.00156763 ], [ -0.01756354, 0.00207241, -0.00156763 ], [ 0.01756354, 0.00207241, -0.00156763 ], [ 0.01756354, -0.00207241, 0.00156763 ], [ 0.00434189, -0.00546006, 0.00222914 ], [ 0.00434189, 0.00546006, -0.00222914 ], [ -0.00434189, 0.00546006, -0.00222914 ], [ -0.00434189, -0.00546006, 0.00222914 ] ]
pbe
true
15
agm005266151-pbe-440
440
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25851376, 7.95708114, 0.0766951 ], [ -3.25851376, 7.95708114, 0.0766951 ], [ 0, 4.46145331, 6.18634949 ] ]
agm005266151
[ [ 1.62925688, 3.97854057, 0.03834755 ], [ -1.62925688, 6.209267225, 3.131522295 ], [ 0.7694950591764783, 4.166309708253495, 2.764033058573332 ], [ 0.7694950591764784, 13.978579226746504, 0.4825318864266674 ], [ -0.7694950591764784, 16.209305881746506, 3.575706631426667 ], [ -0.7694950591764783, 6.397036363253495, 5.857207803573333 ], [ -2.481007058212085, 11.54551452301324, 4.1587554494438566 ], [ -2.481007058212085, 11.06082772198676, 5.274158985556143 ], [ 2.481007058212085, 8.83010106698676, 2.1809842405561426 ], [ 2.481007058212085, 9.31478786801324, 1.0655807044438574 ], [ -1.8512157257992783, 11.425305896635772, 1.961123505275583 ], [ -1.8512157257992783, 6.719583038364228, 1.2854414397244165 ], [ 1.8512157257992783, 8.950309693364229, 4.378616184724417 ], [ 1.8512157257992783, 13.656032551635771, 5.054298250275583 ], [ 0.19252237746042877, 5.264114872990813, 2.543697851996098 ], [ 0.19252237746042855, 12.880774062009186, 0.7028670930039018 ], [ -0.19252237746042855, 15.111500717009186, 3.7960418380039016 ], [ -0.19252237746042877, 7.494841527990813, 5.636872596996097 ], [ -0.7865282881541262, 14.882070511774732, 6.1156378079386595 ], [ -0.7865282881541265, 7.724271733225269, 3.3172766270613403 ], [ 0.7865282881541265, 5.493545078225269, 0.22410188206134002 ], [ 0.7865282881541262, 12.651343856774732, 3.0224630629386597 ] ]
[{"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 ]
[ [ -0.12351302, 0, 0 ], [ 0, -0.36934123, 0.21230997 ], [ 0, 0.21231003, -1.30154374 ] ]
-146.983168
-158.503168
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01431304, -0.01805747, 0.00001893 ], [ 0.01431304, 0.01805747, -0.00001893 ], [ -0.01431304, 0.01805747, -0.00001893 ], [ -0.01431304, -0.01805747, 0.00001893 ], [ -0.00006801, -0.0027015, -0.00249132 ], [ -0.00006801, 0.0027015, 0.00249132 ], [ 0.00006801, 0.0027015, 0.00249132 ], [ 0.00006801, -0.0027015, -0.00249132 ], [ -0.00995096, 0.00480365, 0.01580544 ], [ -0.00995096, -0.00480365, -0.01580544 ], [ 0.00995096, -0.00480365, -0.01580544 ], [ 0.00995096, 0.00480365, 0.01580544 ], [ -0.01704905, -0.00538388, 0.00389359 ], [ -0.01704905, 0.00538388, -0.00389359 ], [ 0.01704905, 0.00538388, -0.00389359 ], [ 0.01704905, -0.00538388, 0.00389359 ], [ 0.00406984, -0.00754541, 0.00231315 ], [ 0.00406984, 0.00754541, -0.00231315 ], [ -0.00406984, 0.00754541, -0.00231315 ], [ -0.00406984, -0.00754541, 0.00231315 ] ]
pbe
true
15
agm005266151-pbe-441
441
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25818098, 7.95581826, 0.07735384 ], [ -3.25818098, 7.95581826, 0.07735384 ], [ 0, 4.46125003, 6.18711151 ] ]
agm005266151
[ [ 1.62909049, 3.97790913, 0.03867692 ], [ -1.62909049, 6.208534145, 3.132232675 ], [ 0.7689095656854399, 4.165392073121135, 2.764419435272734 ], [ 0.7689095656854397, 13.976869461878865, 0.4838439997272661 ], [ -0.7689095656854397, 16.207494476878864, 3.5773997547272667 ], [ -0.7689095656854399, 6.396017088121135, 5.857975190272734 ], [ -2.4807828754073666, 11.544136082895633, 4.160083089716776 ], [ -2.480782875407366, 11.059375482104368, 5.275291855283224 ], [ 2.480782875407366, 8.828750467104367, 2.1817361002832243 ], [ 2.4807828754073666, 9.313511067895632, 1.0665273347167759 ], [ -1.8515670372759914, 11.423446411846784, 1.9623096718875006 ], [ -1.8515670372759914, 6.718815123153215, 1.2859537631124995 ], [ 1.8515670372759914, 8.949440138153216, 4.3795095181125 ], [ 1.8515670372759914, 13.654071426846786, 5.0558654268875 ], [ 0.1916133301975117, 5.26316044848332, 2.543520836078015 ], [ 0.19161333019751137, 12.87910108651668, 0.7047425989219853 ], [ -0.19161333019751137, 15.109726101516681, 3.7982983539219854 ], [ -0.1916133301975117, 7.49378546348332, 5.637076591078015 ], [ -0.7849219286934597, 14.880926196600655, 6.117763474412283 ], [ -0.7849219286934597, 7.722585368399347, 3.3176114705877175 ], [ 0.7849219286934597, 5.491960353399347, 0.2240557155877175 ], [ 0.7849219286934597, 12.650301181600653, 3.0242077194122823 ] ]
[{"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 ]
[ [ -0.04805943, 0, 0 ], [ 0, -0.11411547, 0.31421594 ], [ 0, 0.31421603, -1.00680718 ] ]
-146.983239
-158.503239
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00842843, -0.00318365, 0.00051341 ], [ 0.00842843, 0.00318365, -0.00051341 ], [ -0.00842843, 0.00318365, -0.00051341 ], [ -0.00842843, -0.00318365, 0.00051341 ], [ -0.00125054, 0.00088012, -0.01462705 ], [ -0.00125054, -0.00088012, 0.01462705 ], [ 0.00125054, -0.00088012, 0.01462705 ], [ 0.00125054, 0.00088012, -0.01462705 ], [ -0.00360913, -0.00409509, 0.01035164 ], [ -0.00360913, 0.00409509, -0.01035164 ], [ 0.00360913, 0.00409509, -0.01035164 ], [ 0.00360913, -0.00409509, 0.01035164 ], [ -0.01601776, -0.01198474, 0.00844521 ], [ -0.01601776, 0.01198474, -0.00844521 ], [ 0.01601776, 0.01198474, -0.00844521 ], [ 0.01601776, -0.01198474, 0.00844521 ], [ 0.00405558, -0.01144147, 0.00250444 ], [ 0.00405558, 0.01144147, -0.00250444 ], [ -0.00405558, 0.01144147, -0.00250444 ], [ -0.00405558, -0.01144147, 0.00250444 ] ]
pbe
true
15
agm005266151-pbe-442
442
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25751541, 7.9532925, 0.07867132 ], [ -3.25751541, 7.9532925, 0.07867132 ], [ 0, 4.46084346, 6.18863554 ] ]
agm005266151
[ [ 1.628757705, 3.97664625, 0.03933566 ], [ -1.628757705, 6.20706798, 3.13365343 ], [ 0.7677388218397054, 4.16355671549355, 2.7651918918759812 ], [ 0.7677388218397052, 13.973450014506449, 0.48646851812401903 ], [ -0.7677388218397052, 16.20387174450645, 3.5807862881240187 ], [ -0.7677388218397054, 6.39397844549355, 5.859509661875981 ], [ -2.480334484293485, 11.541379046442556, 4.162738343125295 ], [ -2.480334484293485, 11.056471143557445, 5.277557606874705 ], [ 2.480334484293485, 8.826049413557445, 2.1832398368747046 ], [ 2.480334484293485, 9.310957316442556, 1.0684205731252956 ], [ -1.8522694536945137, 11.419727530113251, 1.9646819495470473 ], [ -1.8522694536945137, 6.71727919988675, 1.2869784604529524 ], [ 1.8522694536945137, 8.94770092988675, 4.381296230452953 ], [ 1.8522694536945137, 13.650149260113253, 5.058999719547048 ], [ 0.18979564982216124, 5.261251295712633, 2.543166465078674 ], [ 0.18979564982216157, 12.875755434287369, 0.7084939449213258 ], [ -0.18979564982216157, 15.106177164287368, 3.802811714921326 ], [ -0.18979564982216124, 7.4916730257126325, 5.637484235078674 ], [ -0.7817098819561918, 14.878637411896323, 6.1220151095076245 ], [ -0.781709881956192, 7.7192127781036755, 3.3182808404923754 ], [ 0.781709881956192, 5.488791048103675, 0.223963070492375 ], [ 0.7817098819561918, 12.648215681896323, 3.027697339507625 ] ]
[{"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 ]
[ [ 0.06480736, 0, 0 ], [ 0, 0.33604347, 0.50767245 ], [ 0, 0.5076723, -0.46935846 ] ]
-146.983223
-158.503223
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00298901, 0.02611249, 0.00125916 ], [ -0.00298901, -0.02611249, -0.00125916 ], [ 0.00298901, -0.02611249, -0.00125916 ], [ 0.00298901, 0.02611249, 0.00125916 ], [ -0.00361044, 0.00816479, -0.0390437 ], [ -0.00361044, -0.00816479, 0.0390437 ], [ 0.00361044, -0.00816479, 0.0390437 ], [ 0.00361044, 0.00816479, -0.0390437 ], [ 0.00857271, -0.02210393, -0.0001252 ], [ 0.00857271, 0.02210393, 0.0001252 ], [ -0.00857271, 0.02210393, 0.0001252 ], [ -0.00857271, -0.02210393, -0.0001252 ], [ -0.01374014, -0.02525008, 0.01704945 ], [ -0.01374014, 0.02525008, -0.01704945 ], [ 0.01374014, 0.02525008, -0.01704945 ], [ 0.01374014, -0.02525008, 0.01704945 ], [ 0.00453344, -0.02005449, 0.00292732 ], [ 0.00453344, 0.02005449, -0.00292732 ], [ -0.00453344, 0.02005449, -0.00292732 ], [ -0.00453344, -0.02005449, 0.00292732 ] ]
pbe
true
15
agm005266151-pbe-443
443
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25788893, 7.95470996, 0.07793195 ], [ -3.25788893, 7.95470996, 0.07793195 ], [ 0, 4.46107163, 6.18778025 ] ]
agm005266151
[ [ 1.628944465, 3.97735498, 0.038965975 ], [ -1.628944465, 6.207890795, 3.1328561 ], [ 0.7683959093630099, 4.164586710637719, 2.7647583146390455 ], [ 0.7683959093630102, 13.97536902436228, 0.4849957103609545 ], [ -0.7683959093630102, 16.20590483936228, 3.5788858353609543 ], [ -0.7683959093630099, 6.395122525637721, 5.858648439639046 ], [ -2.4805861151968163, 11.542926325939721, 4.161248249710225 ], [ -2.4805861151968163, 11.058101039060277, 5.276286025289776 ], [ 2.4805861151968163, 8.827565224060278, 2.182395900289776 ], [ 2.4805861151968163, 9.312390510939721, 1.067358124710224 ], [ -1.8518751909653726, 11.421814638627552, 1.9633506278338646 ], [ -1.8518751909653717, 6.718141096372448, 1.2864033971661355 ], [ 1.8518751909653717, 8.948676911372448, 4.380293522166136 ], [ 1.8518751909653726, 13.652350453627552, 5.057240752833865 ], [ 0.19081585778567212, 5.2623226512666355, 2.5433652285353023 ], [ 0.190815857785672, 12.877633083733363, 0.7063887964646981 ], [ -0.190815857785672, 15.108168898733364, 3.800278921464698 ], [ -0.19081585778567212, 7.492858466266636, 5.637255353535303 ], [ -0.7835127094715455, 14.879921853838452, 6.119629211287338 ], [ -0.7835127094715458, 7.721105511161548, 3.3179050637126632 ], [ 0.7835127094715458, 5.490569696161548, 0.22401493871266304 ], [ 0.7835127094715455, 12.649386038838452, 3.025739086287337 ] ]
[{"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 ]
[ [ -0.0134856, 0, 0 ], [ 0, 0.06508842, 0.39403876 ], [ 0, 0.39403873, -0.78474415 ] ]
-146.983255
-158.503255
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00363307, 0.00936675, 0.00070666 ], [ 0.00363307, -0.00936675, -0.00070666 ], [ -0.00363307, -0.00936675, -0.00070666 ], [ -0.00363307, 0.00936675, 0.00070666 ], [ -0.00226273, 0.0041059, -0.02537092 ], [ -0.00226273, -0.0041059, 0.02537092 ], [ 0.00226273, -0.0041059, 0.02537092 ], [ 0.00226273, 0.0041059, -0.02537092 ], [ 0.00159752, -0.01201164, 0.00624489 ], [ 0.00159752, 0.01201164, -0.00624489 ], [ -0.00159752, 0.01201164, -0.00624489 ], [ -0.00159752, -0.01201164, 0.00624489 ], [ -0.01507104, -0.01777707, 0.01214913 ], [ -0.01507104, 0.01777707, -0.01214913 ], [ 0.01507104, 0.01777707, -0.01214913 ], [ 0.01507104, -0.01777707, 0.01214913 ], [ 0.00449981, -0.0155191, 0.00278228 ], [ 0.00449981, 0.0155191, -0.00278228 ], [ -0.00449981, 0.0155191, -0.00278228 ], [ -0.00449981, -0.0155191, 0.00278228 ] ]
pbe
true
15
agm005266151-pbe-444
444
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25777513, 7.95432314, 0.07834475 ], [ -3.25777513, 7.95432314, 0.07834475 ], [ 0, 4.46117522, 6.18784004 ] ]
agm005266151
[ [ 1.628887565, 3.97716157, 0.039172375 ], [ -1.628887565, 6.20774918, 3.1330923950000003 ], [ 0.7682251403311666, 4.164431122587838, 2.7648589660361895 ], [ 0.7682251403311664, 13.97480276741216, 0.4857505539638106 ], [ -0.7682251403311664, 16.20539037741216, 3.5796705739638113 ], [ -0.7682251403311666, 6.395018732587838, 5.85877898603619 ], [ -2.4805249752261944, 11.542645165612685, 4.161595455164656 ], [ -2.4805249752261944, 11.057763944387315, 5.276854104835344 ], [ 2.4805249752261944, 8.827176334387316, 2.1829340848353445 ], [ 2.4805249752261944, 9.312057555612684, 1.0676754351646556 ], [ -1.8519797452803897, 11.421206127430034, 1.963975715759236 ], [ -1.8519797452803899, 6.718027762569965, 1.2866338042407643 ], [ 1.8519797452803899, 8.948615372569964, 4.3805538242407644 ], [ 1.8519797452803897, 13.651793737430035, 5.057895735759236 ], [ 0.19040757395612562, 5.261965051106434, 2.543395403548477 ], [ 0.19040757395612617, 12.877268838893565, 0.7072141164515227 ], [ -0.19040757395612617, 15.107856448893564, 3.801134136451523 ], [ -0.19040757395612562, 7.4925526611064335, 5.637315423548477 ], [ -0.7829447457010457, 14.879644623557773, 6.120424561017323 ], [ -0.7829447457010458, 7.720764486442228, 3.318024998982677 ], [ 0.7829447457010458, 5.490176876442227, 0.2241049789826768 ], [ 0.7829447457010457, 12.649057013557773, 3.026504541017323 ] ]
[{"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 ]
[ [ 0.05099244, 0, 0 ], [ 0, 0.18883163, 0.40463617 ], [ 0, 0.40463616, -0.68880572 ] ]
-146.983308
-158.503308
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00267281, 0.00937601, -0.00192094 ], [ 0.00267281, -0.00937601, 0.00192094 ], [ -0.00267281, -0.00937601, 0.00192094 ], [ -0.00267281, 0.00937601, -0.00192094 ], [ -0.00206542, -0.00771582, 0.00194348 ], [ -0.00206542, 0.00771582, -0.00194348 ], [ 0.00206542, 0.00771582, -0.00194348 ], [ 0.00206542, -0.00771582, 0.00194348 ], [ 0.0040076, -0.01328345, 0.00246799 ], [ 0.0040076, 0.01328345, -0.00246799 ], [ -0.0040076, 0.01328345, -0.00246799 ], [ -0.0040076, -0.01328345, 0.00246799 ], [ -0.01597503, -0.01376808, 0.01048955 ], [ -0.01597503, 0.01376808, -0.01048955 ], [ 0.01597503, 0.01376808, -0.01048955 ], [ 0.01597503, -0.01376808, 0.01048955 ], [ 0.0034198, -0.01475739, 0.00302587 ], [ 0.0034198, 0.01475739, -0.00302587 ], [ -0.0034198, 0.01475739, -0.00302587 ], [ -0.0034198, -0.01475739, 0.00302587 ] ]
pbe
true
15
agm005266151-pbe-445
445
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25762786, 7.95382253, 0.07887899 ], [ -3.25762786, 7.95382253, 0.07887899 ], [ 0, 4.46130929, 6.18791741 ] ]
agm005266151
[ [ 1.62881393, 3.976911265, 0.039439495 ], [ -1.62881393, 6.20756591, 3.1333982 ], [ 0.7680041084398517, 4.164229759371652, 2.7649892036632475 ], [ 0.7680041084398517, 13.974069945628345, 0.48672748133675253 ], [ -0.7680041084398517, 16.204724590628345, 3.580686186336752 ], [ -0.7680041084398517, 6.394884404371654, 5.858947908663247 ], [ -2.4804457759799416, 11.542281384092382, 4.162044895326243 ], [ -2.4804457759799416, 11.057327610907619, 5.277589199673757 ], [ 2.4804457759799416, 8.826672965907619, 2.183630494673757 ], [ 2.4804457759799416, 9.311626739092382, 1.068086190326243 ], [ -1.8521150681398777, 11.420418688185599, 1.9647846754692058 ], [ -1.8521150681398775, 6.717881016814402, 1.2869320095307941 ], [ 1.8521150681398775, 8.9485356618144, 4.380890714530794 ], [ 1.8521150681398777, 13.651073333185598, 5.058743380469205 ], [ 0.18987921192370016, 5.261502353063953, 2.5434344754351526 ], [ 0.18987921192370028, 12.876797351936046, 0.7082822095648474 ], [ -0.18987921192370028, 15.107451996936046, 3.8022409145648473 ], [ -0.18987921192370016, 7.492156998063953, 5.6373931804351525 ], [ -0.7822096788252324, 14.879285924414567, 6.121453886067731 ], [ -0.7822096788252324, 7.720323070585431, 3.318180208932269 ], [ 0.7822096788252324, 5.489668425585432, 0.2242215039322688 ], [ 0.7822096788252324, 12.648631279414568, 3.0274951810677306 ] ]
[{"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 ]
[ [ 0.1298534, 0, 0 ], [ 0, 0.34291209, 0.416051 ], [ 0, 0.41605097, -0.56236863 ] ]
-146.983341
-158.503341
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.0016758, 0.00933353, -0.00538005 ], [ 0.0016758, -0.00933353, 0.00538005 ], [ -0.0016758, -0.00933353, 0.00538005 ], [ -0.0016758, 0.00933353, -0.00538005 ], [ -0.00181375, -0.02296671, 0.03720092 ], [ -0.00181375, 0.02296671, -0.03720092 ], [ 0.00181375, 0.02296671, -0.03720092 ], [ 0.00181375, -0.02296671, 0.03720092 ], [ 0.0070058, -0.01489764, -0.00233354 ], [ 0.0070058, 0.01489764, 0.00233354 ], [ -0.0070058, 0.01489764, 0.00233354 ], [ -0.0070058, -0.01489764, -0.00233354 ], [ -0.01746055, -0.00842873, 0.0081731 ], [ -0.01746055, 0.00842873, -0.0081731 ], [ 0.01746055, 0.00842873, -0.0081731 ], [ 0.01746055, -0.00842873, 0.0081731 ], [ 0.00216405, -0.0137211, 0.00339209 ], [ 0.00216405, 0.0137211, -0.00339209 ], [ -0.00216405, 0.0137211, -0.00339209 ], [ -0.00216405, -0.0137211, 0.00339209 ] ]
pbe
true
15
agm005266151-pbe-446
446
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25754942, 7.95361059, 0.07936184 ], [ -3.25754942, 7.95361059, 0.07936184 ], [ 0, 4.46156623, 6.18790072 ] ]
agm005266151
[ [ 1.62877471, 3.976805295, 0.03968092 ], [ -1.62877471, 6.20758841, 3.13363128 ], [ 0.7678719598689708, 4.164247750899857, 2.765056716182288 ], [ 0.7678719598689709, 13.973756544100143, 0.48761732381771195 ], [ -0.7678719598689709, 16.204539659100142, 3.581567683817712 ], [ -0.7678719598689708, 6.395030865899858, 5.859007076182288 ], [ -2.480415823648545, 11.542174605478998, 4.162609512714211 ], [ -2.4804158236485443, 11.057395919521003, 5.277965247285789 ], [ 2.4804158236485443, 8.826612804521003, 2.1840148872857887 ], [ 2.480415823648545, 9.311391490478998, 1.068659152714211 ], [ -1.8521811302544444, 11.420033304618206, 1.9654515522801448 ], [ -1.8521811302544446, 6.717970990381794, 1.2872224877198553 ], [ 1.8521811302544446, 8.948754105381793, 4.381172847719855 ], [ 1.8521811302544444, 13.650816419618206, 5.059401912280145 ], [ 0.1894562401992047, 5.261280675930757, 2.543528679919124 ], [ 0.18945624019920437, 12.876723619069244, 0.709145360080876 ], [ -0.18945624019920437, 15.107506734069243, 3.803095720080876 ], [ -0.1894562401992047, 7.492063790930757, 5.637479039919125 ], [ -0.7817252425609225, 14.879305732416853, 6.122253360392614 ], [ -0.7817252425609222, 7.720264792583146, 3.3183213996073855 ], [ 0.7817252425609222, 5.4894816775831465, 0.2243710396073856 ], [ 0.7817252425609225, 12.648522617416853, 3.0283030003926146 ] ]
[{"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 ]
[ [ 0.16325317, 0, 0 ], [ 0, 0.40833845, 0.24896973 ], [ 0, 0.24896978, -0.1997447 ] ]
-146.983398
-158.503398
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00183559, 0.00416586, -0.00340552 ], [ 0.00183559, -0.00416586, 0.00340552 ], [ -0.00183559, -0.00416586, 0.00340552 ], [ -0.00183559, 0.00416586, -0.00340552 ], [ -0.00148492, -0.01420433, 0.01778409 ], [ -0.00148492, 0.01420433, -0.01778409 ], [ 0.00148492, 0.01420433, -0.01778409 ], [ 0.00148492, -0.01420433, 0.01778409 ], [ 0.00678636, -0.01284291, -0.00326201 ], [ 0.00678636, 0.01284291, 0.00326201 ], [ -0.00678636, 0.01284291, 0.00326201 ], [ -0.00678636, -0.01284291, -0.00326201 ], [ -0.01727127, -0.00547165, 0.00559164 ], [ -0.01727127, 0.00547165, -0.00559164 ], [ 0.01727127, 0.00547165, -0.00559164 ], [ 0.01727127, -0.00547165, 0.00559164 ], [ 0.00067192, -0.0113364, 0.00382433 ], [ 0.00067192, 0.0113364, -0.00382433 ], [ -0.00067192, 0.0113364, -0.00382433 ], [ -0.00067192, -0.0113364, 0.00382433 ] ]
pbe
true
15
agm005266151-pbe-447
447
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25734393, 7.95305536, 0.0806268 ], [ -3.25734393, 7.95305536, 0.0806268 ], [ 0, 4.46223935, 6.18785699 ] ]
agm005266151
[ [ 1.628671965, 3.97652768, 0.0403134 ], [ -1.628671965, 6.207647355, 3.134241895 ], [ 0.7675257352320276, 4.164295116709001, 2.765233679522151 ], [ 0.7675257352320277, 13.972935278290997, 0.4899484154778494 ], [ -0.7675257352320277, 16.204054953290996, 3.5838769104778496 ], [ -0.7675257352320276, 6.395414791709001, 5.859162174522151 ], [ -2.4803373369518757, 11.541894708072668, 4.164088632884981 ], [ -2.4803373369518753, 11.057575036927332, 5.278950452115019 ], [ 2.4803373369518753, 8.826455361927332, 2.1850219571150187 ], [ 2.4803373369518757, 9.310775033072668, 1.0701601378849814 ], [ -1.852354098407493, 11.419023698861663, 1.9671984664620268 ], [ -1.8523540984074933, 6.718206696138335, 1.2879836285379733 ], [ 1.8523540984074933, 8.949326371138335, 4.381912123537973 ], [ 1.852354098407493, 13.650143373861663, 5.061126961462026 ], [ 0.1883481602736965, 5.260700049760078, 2.543775338043391 ], [ 0.18834816027369694, 12.876530345239921, 0.7114067569566087 ], [ -0.18834816027369694, 15.10765002023992, 3.805335251956609 ], [ -0.1883481602736965, 7.491819724760077, 5.637703833043393 ], [ -0.7804561202699953, 14.879357604621838, 6.124347859438502 ], [ -0.780456120269995, 7.720112140378163, 3.318691225561498 ], [ 0.780456120269995, 5.488992465378162, 0.22476273056149793 ], [ 0.7804561202699953, 12.648237929621837, 3.0304193644385022 ] ]
[{"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 ]
[ [ 0.20342662, 0, 0 ], [ 0, 0.53913442, -0.19215926 ], [ 0, -0.19215924, 0.71105715 ] ]
-146.983461
-158.503461
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00248478, -0.0093153, 0.00181336 ], [ 0.00248478, 0.0093153, -0.00181336 ], [ -0.00248478, 0.0093153, -0.00181336 ], [ -0.00248478, -0.0093153, 0.00181336 ], [ -0.00022177, 0.00902942, -0.03361104 ], [ -0.00022177, -0.00902942, 0.03361104 ], [ 0.00022177, -0.00902942, 0.03361104 ], [ 0.00022177, 0.00902942, -0.03361104 ], [ 0.00657749, -0.00680043, -0.00534227 ], [ 0.00657749, 0.00680043, 0.00534227 ], [ -0.00657749, 0.00680043, 0.00534227 ], [ -0.00657749, -0.00680043, -0.00534227 ], [ -0.01608642, 0.00235998, -0.00131094 ], [ -0.01608642, -0.00235998, 0.00131094 ], [ 0.01608642, -0.00235998, 0.00131094 ], [ 0.01608642, 0.00235998, -0.00131094 ], [ -0.0032766, -0.0054517, 0.00444573 ], [ -0.0032766, 0.0054517, -0.00444573 ], [ 0.0032766, 0.0054517, -0.00444573 ], [ 0.0032766, -0.0054517, 0.00444573 ] ]
pbe
true
15
agm005266151-pbe-448
448
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25727131, 7.95300124, 0.08122283 ], [ -3.25727131, 7.95300124, 0.08122283 ], [ 0, 4.4626709, 6.18803614 ] ]
agm005266151
[ [ 1.628635655, 3.97650062, 0.040611415 ], [ -1.628635655, 6.20783607, 3.134629485 ], [ 0.7673642289936369, 4.164359609704614, 2.765406998516439 ], [ 0.7673642289936367, 13.972978320295386, 0.4910567314835611 ], [ -0.7673642289936367, 16.204313770295386, 3.585074801483561 ], [ -0.7673642289936369, 6.3956950597046145, 5.8594250685164395 ], [ -2.4803253940027274, 11.542111598197792, 4.164713643828382 ], [ -2.480325394002728, 11.057897231802206, 5.279786226171618 ], [ 2.480325394002728, 8.826561781802207, 2.1857681561716182 ], [ 2.4803253940027274, 9.310776148197792, 1.0706955738283817 ], [ -1.852427034089673, 11.418768249496454, 1.968058450722662 ], [ -1.8524270340896727, 6.718569680503546, 1.2884052792773382 ], [ 1.8524270340896727, 8.949905130503547, 4.382423349277339 ], [ 1.852427034089673, 13.650103699496453, 5.062076520722662 ], [ 0.18765250764134533, 5.260536949695697, 2.5439452004354757 ], [ 0.18765250764134578, 12.876800980304303, 0.7125185295645249 ], [ -0.18765250764134578, 15.108136430304302, 3.806536599564525 ], [ -0.18765250764134533, 7.491872399695698, 5.637963270435475 ], [ -0.7798033898266827, 14.879742743366037, 6.125587848883177 ], [ -0.7798033898266828, 7.720266086633961, 3.3189120211168226 ], [ 0.7798033898266828, 5.488930636633961, 0.224893951116822 ], [ 0.7798033898266827, 12.648407293366038, 3.031569778883178 ] ]
[{"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 ]
[ [ 0.1542715, 0, 0 ], [ 0, 0.29135295, -0.27365899 ], [ 0, -0.27365897, 0.76288324 ] ]
-146.983499
-158.503499
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00026997, -0.00983832, -0.00334494 ], [ 0.00026997, 0.00983832, 0.00334494 ], [ -0.00026997, 0.00983832, 0.00334494 ], [ -0.00026997, -0.00983832, -0.00334494 ], [ 0.00046089, 0.00146715, -0.01450342 ], [ 0.00046089, -0.00146715, 0.01450342 ], [ -0.00046089, -0.00146715, 0.01450342 ], [ -0.00046089, 0.00146715, -0.01450342 ], [ 0.00425777, -0.00110528, -0.00446263 ], [ 0.00425777, 0.00110528, 0.00446263 ], [ -0.00425777, 0.00110528, 0.00446263 ], [ -0.00425777, -0.00110528, -0.00446263 ], [ -0.0111841, -0.00078519, -0.00406499 ], [ -0.0111841, 0.00078519, 0.00406499 ], [ 0.0111841, 0.00078519, 0.00406499 ], [ 0.0111841, -0.00078519, -0.00406499 ], [ -0.00567074, -0.00105887, 0.00468265 ], [ -0.00567074, 0.00105887, -0.00468265 ], [ 0.00567074, 0.00105887, -0.00468265 ], [ 0.00567074, -0.00105887, 0.00468265 ] ]
pbe
true
15
agm005266151-pbe-449
449
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.51354698, 7.1693568, -0.04203118 ], [ -3.51354698, 7.1693568, -0.04203118 ], [ 0, 3.93745575, 6.07835288 ] ]
agm005266151
[ [ 1.75677349, 3.5846784, -0.02101559 ], [ -1.75677349, 5.553406275, 3.0181608499999997 ], [ 0.7925746492625941, 3.746231280592794, 2.675779944537071 ], [ 0.7925746492625945, 12.561210194407206, 0.2793341354629286 ], [ -0.7925746492625945, 14.529938069407205, 3.3185105754629283 ], [ -0.7925746492625941, 5.714959155592794, 5.714956384537071 ], [ -2.7005154764266917, 10.355549955355526, 3.9552482378260567 ], [ -2.700515476426691, 9.889347269644475, 5.0782187221739425 ], [ 2.700515476426691, 7.920619394644476, 2.0390422821739427 ], [ 2.7005154764266917, 8.386822080355527, 0.9160717978260574 ], [ -2.0036511820471494, 10.265083113992691, 1.782228254540543 ], [ -2.0036511820471494, 6.042358361007309, 1.1728858254594567 ], [ 2.0036511820471494, 8.011086236007309, 4.212062265459457 ], [ 2.0036511820471494, 12.23381098899269, 4.821404694540543 ], [ 0.1253400614299227, 4.78303709949563, 2.416245248205272 ], [ 0.12534006142992205, 11.52440437550437, 0.5388688317947278 ], [ -0.12534006142992205, 13.49313225050437, 3.5780452717947275 ], [ -0.1253400614299227, 6.751764974495629, 5.455421688205272 ], [ -1.059005054576095, 13.108385139377353, 5.804303482288551 ], [ -1.0590050545760947, 7.1365120856226465, 3.2291634777114484 ], [ 1.0590050545760947, 5.167784210622647, 0.1899870377114488 ], [ 1.059005054576095, 11.139657264377353, 2.765127042288551 ] ]
[{"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 ]
[ [ 2.64192332, 0, 0 ], [ 0, 3.64530116, -0.42337777 ], [ 0, -0.42337781, 4.81773282 ] ]
-146.8293
-158.3493
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01692082, 0.01292843, -0.11576256 ], [ 0.01692082, -0.01292843, 0.11576256 ], [ -0.01692082, -0.01292843, 0.11576256 ], [ -0.01692082, 0.01292843, -0.11576256 ], [ 0.02032816, 0.00069978, 0.06728816 ], [ 0.02032816, -0.00069978, -0.06728816 ], [ -0.02032816, -0.00069978, -0.06728816 ], [ -0.02032816, 0.00069978, 0.06728816 ], [ 0.05717977, -0.06281693, 0.06712472 ], [ 0.05717977, 0.06281693, -0.06712472 ], [ -0.05717977, 0.06281693, -0.06712472 ], [ -0.05717977, -0.06281693, 0.06712472 ], [ 0.00561511, 0.01962482, 0.07630432 ], [ 0.00561511, -0.01962482, -0.07630432 ], [ -0.00561511, -0.01962482, -0.07630432 ], [ -0.00561511, 0.01962482, 0.07630432 ], [ 0.02779116, -0.01945729, 0.0055212 ], [ 0.02779116, 0.01945729, -0.0055212 ], [ -0.02779116, 0.01945729, -0.0055212 ], [ -0.02779116, -0.01945729, 0.0055212 ] ]
pbe
true
15
agm005266151-pbe-45
45
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25721117, 7.95295641, 0.0817165 ], [ -3.25721117, 7.95295641, 0.0817165 ], [ 0, 4.46302834, 6.18818452 ] ]
agm005266151
[ [ 1.628605585, 3.976478205, 0.04085825 ], [ -1.628605585, 6.207992375, 3.13495051 ], [ 0.7672304235460643, 4.164413022181026, 2.7655505195990293 ], [ 0.7672304235460641, 13.973013967818975, 0.4919747404009708 ], [ -0.7672304235460641, 16.204528137818976, 3.5860670004009703 ], [ -0.7672304235460643, 6.395927192181025, 5.859642779599029 ], [ -2.48031552603286, 11.54229124193929, 4.165231277546231 ], [ -2.48031552603286, 11.058164088060709, 5.28047850245377 ], [ 2.48031552603286, 8.82664991806071, 2.1863862424537692 ], [ 2.48031552603286, 9.31077707193929, 1.071139017546231 ], [ -1.8524874215731257, 11.41855681880681, 1.9687707463501065 ], [ -1.8524874215731262, 6.718870171193191, 1.2887545136498935 ], [ 1.8524874215731262, 8.950384341193192, 4.382846773649893 ], [ 1.8524874215731257, 13.650070988806808, 5.062863006350107 ], [ 0.18707632751547665, 5.260401911407687, 2.544085959660002 ], [ 0.18707632751547676, 12.877025078592311, 0.7134393003399983 ], [ -0.18707632751547676, 15.108539248592312, 3.8075315603399984 ], [ -0.18707632751547665, 7.491916081407687, 5.638178219660001 ], [ -0.7792627896128261, 14.880061583564041, 6.126614828698004 ], [ -0.7792627896128261, 7.720393746435957, 3.3190949513019974 ], [ 0.7792627896128261, 5.4888795764359575, 0.2250026913019974 ], [ 0.7792627896128261, 12.64854741356404, 3.0325225686980026 ] ]
[{"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 ]
[ [ 0.09927917, 0, 0 ], [ 0, 0.07803541, -0.33890712 ], [ 0, -0.33890717, 0.79376967 ] ]
-146.983509
-158.503509
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00155234, -0.01023674, -0.00744873 ], [ -0.00155234, 0.01023674, 0.00744873 ], [ 0.00155234, 0.01023674, 0.00744873 ], [ 0.00155234, -0.01023674, -0.00744873 ], [ 0.00105578, -0.00479301, 0.0013686 ], [ 0.00105578, 0.00479301, -0.0013686 ], [ -0.00105578, 0.00479301, -0.0013686 ], [ -0.00105578, -0.00479301, 0.0013686 ], [ 0.00244267, 0.00355907, -0.00350362 ], [ 0.00244267, -0.00355907, 0.00350362 ], [ -0.00244267, -0.00355907, 0.00350362 ], [ -0.00244267, 0.00355907, -0.00350362 ], [ -0.00716043, -0.00341103, -0.00621761 ], [ -0.00716043, 0.00341103, 0.00621761 ], [ 0.00716043, 0.00341103, 0.00621761 ], [ 0.00716043, -0.00341103, -0.00621761 ], [ -0.00758041, 0.0024734, 0.00489942 ], [ -0.00758041, -0.0024734, -0.00489942 ], [ 0.00758041, -0.0024734, -0.00489942 ], [ 0.00758041, 0.0024734, 0.00489942 ] ]
pbe
true
15
agm005266151-pbe-450
450
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.2572204, 7.95298677, 0.08164228 ], [ -3.2572204, 7.95298677, 0.08164228 ], [ 0, 4.46298499, 6.1884415 ] ]
agm005266151
[ [ 1.6286102, 3.976493385, 0.04082114 ], [ -1.6286102, 6.20798588, 3.1350418899999997 ], [ 0.767196637943288, 4.164307703486104, 2.7655772137470582 ], [ 0.7671966379432877, 13.973158331513895, 0.491928096252942 ], [ -0.7671966379432877, 16.204650826513895, 3.5861488462529416 ], [ -0.767196637943288, 6.3958001984861035, 5.859797963747058 ], [ -2.480322098523108, 11.542258630548456, 4.165307023565271 ], [ -2.480322098523108, 11.058192394451542, 5.280639786434729 ], [ 2.480322098523108, 8.826699899451542, 2.1864190364347293 ], [ 2.480322098523108, 9.310766135548457, 1.0710862735652709 ], [ -1.8524940064502478, 11.41855474293332, 1.968737024379207 ], [ -1.8524940064502482, 6.7189112920666805, 1.288768285620793 ], [ 1.8524940064502482, 8.95040378706668, 4.382989035620793 ], [ 1.8524940064502478, 13.65004723793332, 5.062957774379207 ], [ 0.18690670044230806, 5.2603189223451015, 2.544084639599276 ], [ 0.18690670044230773, 12.877147112654896, 0.7134206704007242 ], [ -0.18690670044230773, 15.108639607654897, 3.8076414204007243 ], [ -0.18690670044230806, 7.491811417345101, 5.638305389599275 ], [ -0.7792131754429681, 14.88008422421757, 6.126849389067757 ], [ -0.779213175442968, 7.720366800782429, 3.319097420932243 ], [ 0.779213175442968, 5.488874305782429, 0.2248766709322434 ], [ 0.7792131754429681, 12.648591729217571, 3.0326286390677564 ] ]
[{"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 ]
[ [ 0.06758863, 0, 0 ], [ 0, -0.05908752, -0.25095409 ], [ 0, -0.2509541, 0.61241957 ] ]
-146.98353
-158.50353
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00367423, -0.00747112, -0.00530002 ], [ -0.00367423, 0.00747112, 0.00530002 ], [ 0.00367423, 0.00747112, 0.00530002 ], [ 0.00367423, -0.00747112, -0.00530002 ], [ 0.00093255, -0.00562597, 0.00308828 ], [ 0.00093255, 0.00562597, -0.00308828 ], [ -0.00093255, 0.00562597, -0.00308828 ], [ -0.00093255, -0.00562597, 0.00308828 ], [ 0.00235764, 0.00334641, -0.00351345 ], [ 0.00235764, -0.00334641, 0.00351345 ], [ -0.00235764, -0.00334641, 0.00351345 ], [ -0.00235764, 0.00334641, -0.00351345 ], [ -0.00564294, -0.00763918, -0.00533651 ], [ -0.00564294, 0.00763918, 0.00533651 ], [ 0.00564294, 0.00763918, 0.00533651 ], [ 0.00564294, -0.00763918, -0.00533651 ], [ -0.00721578, 0.00261992, 0.0053226 ], [ -0.00721578, -0.00261992, -0.0053226 ], [ 0.00721578, -0.00261992, -0.0053226 ], [ 0.00721578, 0.00261992, 0.0053226 ] ]
pbe
true
15
agm005266151-pbe-451
451
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25724811, 7.95307782, 0.08141962 ], [ -3.25724811, 7.95307782, 0.08141962 ], [ 0, 4.46285492, 6.18921244 ] ]
agm005266151
[ [ 1.628624055, 3.97653891, 0.04070981 ], [ -1.628624055, 6.207966369999999, 3.1353160300000003 ], [ 0.767095284622251, 4.163991326352579, 2.7656571413113538 ], [ 0.767095284622251, 13.97359177364742, 0.491788318688646 ], [ -0.767095284622251, 16.20501923364742, 3.5863945386886464 ], [ -0.767095284622251, 6.395418786352579, 5.860263361311354 ], [ -2.4803418963529857, 11.542160795212435, 4.165534320120233 ], [ -2.4803418963529857, 11.058277224787563, 5.281123579879767 ], [ 2.4803418963529857, 8.826849764787564, 2.186517359879767 ], [ 2.4803418963529857, 9.310733335212435, 1.0709281001202329 ], [ -1.8525138050742245, 11.418548303233347, 1.9686357270888457 ], [ -1.8525138050742243, 6.719034796766653, 1.2888097329111545 ], [ 1.8525138050742243, 8.950462256766652, 4.383415952911155 ], [ 1.8525138050742245, 13.649975763233346, 5.063241947088846 ], [ 0.18639778200872936, 5.2600700185140274, 2.5440806467464125 ], [ 0.18639778200872925, 12.877513081485972, 0.7133648132535877 ], [ -0.18639778200872925, 15.108940541485971, 3.8079710332535877 ], [ -0.18639778200872936, 7.491497478514027, 5.638686866746413 ], [ -0.7790643359547762, 14.880152033705382, 6.127553053804302 ], [ -0.779064335954776, 7.720285986294615, 3.3191048461956982 ], [ 0.779064335954776, 5.4888585262946155, 0.2244986261956978 ], [ 0.7790643359547762, 12.648724573705383, 3.0329468338043024 ] ]
[{"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 ]
[ [ -0.01646144, 0, 0 ], [ 0, -0.44995262, 0.00618544 ], [ 0, 0.00618539, 0.09318781 ] ]
-146.983572
-158.503572
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01016761, 0.00122865, 0.00050188 ], [ -0.01016761, -0.00122865, -0.00050188 ], [ 0.01016761, -0.00122865, -0.00050188 ], [ 0.01016761, 0.00122865, 0.00050188 ], [ 0.00079858, -0.00753406, 0.00813483 ], [ 0.00079858, 0.00753406, -0.00813483 ], [ -0.00079858, 0.00753406, -0.00813483 ], [ -0.00079858, -0.00753406, 0.00813483 ], [ 0.00183916, 0.00437962, -0.00364221 ], [ 0.00183916, -0.00437962, 0.00364221 ], [ -0.00183916, -0.00437962, 0.00364221 ], [ -0.00183916, 0.00437962, -0.00364221 ], [ 0.00225411, -0.01933334, -0.00260829 ], [ 0.00225411, 0.01933334, 0.00260829 ], [ -0.00225411, 0.01933334, 0.00260829 ], [ -0.00225411, -0.01933334, -0.00260829 ], [ -0.00716134, 0.00313964, 0.00361127 ], [ -0.00716134, -0.00313964, -0.00361127 ], [ 0.00716134, -0.00313964, -0.00361127 ], [ 0.00716134, 0.00313964, 0.00361127 ] ]
pbe
true
15
agm005266151-pbe-452
452
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25730352, 7.95325994, 0.08097431 ], [ -3.25730352, 7.95325994, 0.08097431 ], [ 0, 4.46259478, 6.19075434 ] ]
agm005266151
[ [ 1.62865176, 3.97662997, 0.040487155 ], [ -1.62865176, 6.207927359999999, 3.135864325 ], [ 0.7668925701192673, 4.163358637695859, 2.7658169446455707 ], [ 0.7668925701192673, 13.97445863230414, 0.4915088453544292 ], [ -0.7668925701192673, 16.20575602230414, 3.5868860153544286 ], [ -0.7668925701192673, 6.394656027695859, 5.861194114645571 ], [ -2.480381451758371, 11.54196506587755, 4.165988921183965 ], [ -2.480381451758371, 11.05844698412245, 5.282091208816035 ], [ 2.480381451758371, 8.82714959412245, 2.1867140388160355 ], [ 2.480381451758371, 9.31066767587755, 1.0706117511839648 ], [ -1.8525533968409567, 11.41853565617467, 1.968433184143357 ], [ -1.8525533968409569, 6.719281613825329, 1.2888926058566428 ], [ 1.8525533968409569, 8.950579003825329, 4.384269775856643 ], [ 1.8525533968409567, 13.64983304617467, 5.0638103541433575 ], [ 0.18537995108755678, 5.259572410604117, 2.5440726474147333 ], [ 0.1853799510875569, 12.878244859395883, 0.7132531425852664 ], [ -0.1853799510875569, 15.109542249395883, 3.808630312585266 ], [ -0.18537995108755678, 7.490869800604117, 5.639449817414733 ], [ -0.7787666792250048, 14.88028767523663, 6.128960559676283 ], [ -0.7787666792250049, 7.720124374763369, 3.3191195703237164 ], [ 0.7787666792250049, 5.488826984763369, 0.2237424003237164 ], [ 0.7787666792250048, 12.64899028523663, 3.0335833896762834 ] ]
[{"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 ]
[ [ -0.19746455, 0, 0 ], [ 0, -1.25125775, 0.51363422 ], [ 0, 0.51363438, -0.95557936 ] ]
-146.983543
-158.503543
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.02291993, 0.0184566, 0.01221926 ], [ -0.02291993, -0.0184566, -0.01221926 ], [ 0.02291993, -0.0184566, -0.01221926 ], [ 0.02291993, 0.0184566, 0.01221926 ], [ 0.00043733, -0.01150749, 0.018073 ], [ 0.00043733, 0.01150749, -0.018073 ], [ -0.00043733, 0.01150749, -0.018073 ], [ -0.00043733, -0.01150749, 0.018073 ], [ 0.00085987, 0.00564185, -0.00322562 ], [ 0.00085987, -0.00564185, 0.00322562 ], [ -0.00085987, -0.00564185, 0.00322562 ], [ -0.00085987, 0.00564185, -0.00322562 ], [ 0.01612019, -0.04358006, 0.00248945 ], [ 0.01612019, 0.04358006, -0.00248945 ], [ -0.01612019, 0.04358006, -0.00248945 ], [ -0.01612019, -0.04358006, 0.00248945 ], [ -0.00621953, 0.00404719, 0.00186488 ], [ -0.00621953, -0.00404719, -0.00186488 ], [ 0.00621953, -0.00404719, -0.00186488 ], [ 0.00621953, 0.00404719, 0.00186488 ] ]
pbe
true
15
agm005266151-pbe-453
453
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25726436, 7.95313124, 0.08128902 ], [ -3.25726436, 7.95313124, 0.08128902 ], [ 0, 4.46277862, 6.18966467 ] ]
agm005266151
[ [ 1.62863218, 3.97656562, 0.04064451 ], [ -1.62863218, 6.20795493, 3.135476845 ], [ 0.7670358229173614, 4.163805732178021, 2.7657039279706717 ], [ 0.7670358229173613, 13.973846057821978, 0.4917064470293281 ], [ -0.7670358229173613, 16.205235367821977, 3.5865387820293284 ], [ -0.7670358229173614, 6.395195042178022, 5.860536262970672 ], [ -2.480353488722427, 11.542103325667338, 4.165667658366931 ], [ -2.480353488722427, 11.058327084332662, 5.28140738663307 ], [ 2.480353488722427, 8.826937774332663, 2.18657505163307 ], [ 2.480353488722427, 9.310714015667337, 1.0708353233669299 ], [ -1.8525254248349323, 11.418544679838295, 1.968576324683007 ], [ -1.8525254248349323, 6.719107110161706, 1.288834050316993 ], [ 1.8525254248349323, 8.950496420161706, 4.383666385316993 ], [ 1.8525254248349323, 13.649933989838294, 5.063408659683007 ], [ 0.186099239038496, 5.2599240876525135, 2.5440782590593476 ], [ 0.18609923903849568, 12.877727702347485, 0.7133321159406523 ], [ -0.18609923903849568, 15.109117012347486, 3.808164450940652 ], [ -0.186099239038496, 7.4913133976525135, 5.6389105940593485 ], [ -0.7789770192064085, 14.880191758943427, 6.127965937570141 ], [ -0.7789770192064084, 7.720238651056572, 3.3191091074298584 ], [ 0.7789770192064084, 5.488849341056572, 0.22427677242985822 ], [ 0.7789770192064085, 12.648802448943428, 3.033133602570142 ] ]
[{"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 ]
[ [ -0.08131396, 0, 0 ], [ 0, -0.69511797, 0.14941828 ], [ 0, 0.14941836, -0.21687024 ] ]
-146.983579
-158.503579
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01375767, 0.00630793, 0.00416513 ], [ -0.01375767, -0.00630793, -0.00416513 ], [ 0.01375767, -0.00630793, -0.00416513 ], [ 0.01375767, 0.00630793, 0.00416513 ], [ 0.00069885, -0.00862047, 0.01100444 ], [ 0.00069885, 0.00862047, -0.01100444 ], [ -0.00069885, 0.00862047, -0.01100444 ], [ -0.00069885, -0.00862047, 0.01100444 ], [ 0.00155448, 0.00472592, -0.00312928 ], [ 0.00155448, -0.00472592, 0.00312928 ], [ -0.00155448, -0.00472592, 0.00312928 ], [ -0.00155448, 0.00472592, -0.00312928 ], [ 0.00571864, -0.02657787, -0.00121833 ], [ 0.00571864, 0.02657787, 0.00121833 ], [ -0.00571864, 0.02657787, 0.00121833 ], [ -0.00571864, -0.02657787, -0.00121833 ], [ -0.00672186, 0.00348911, 0.0033509 ], [ -0.00672186, -0.00348911, -0.0033509 ], [ 0.00672186, -0.00348911, -0.0033509 ], [ 0.00672186, 0.00348911, 0.0033509 ] ]
pbe
true
15
agm005266151-pbe-454
454
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25726444, 7.95300573, 0.08126241 ], [ -3.25726444, 7.95300573, 0.08126241 ], [ 0, 4.46268561, 6.18984825 ] ]
agm005266151
[ [ 1.62863222, 3.976502865, 0.040631205 ], [ -1.62863222, 6.20784567, 3.13555533 ], [ 0.7669663643056297, 4.163674720585772, 2.7657379691756354 ], [ 0.7669663643056297, 13.973679544414228, 0.4917109758243645 ], [ -0.7669663643056297, 16.20502234941423, 3.586635100824364 ], [ -0.7669663643056297, 6.395017525585772, 5.860662094175636 ], [ -2.4803511066927872, 11.541851627177905, 4.165782424793214 ], [ -2.4803511066927872, 11.058188247822095, 5.281514770206785 ], [ 2.4803511066927872, 8.826845442822094, 2.186590645206785 ], [ 2.4803511066927872, 9.310508822177907, 1.0708582997932148 ], [ -1.8525218547703313, 11.418350219810161, 1.968575020224146 ], [ -1.8525218547703313, 6.719004045189841, 1.2888739247758538 ], [ 1.8525218547703313, 8.950346850189842, 4.383798049775854 ], [ 1.8525218547703313, 13.64969302481016, 5.063499145224146 ], [ 0.18598273126016507, 5.25969064794216, 2.544079955589647 ], [ 0.1859827312601654, 12.87766361705784, 0.7133689894103529 ], [ -0.1859827312601654, 15.10900642205784, 3.808293114410353 ], [ -0.18598273126016507, 7.49103345294216, 5.639004080589647 ], [ -0.7789565175724915, 14.879964713538378, 6.128184431111498 ], [ -0.7789565175724917, 7.720075161461624, 3.319112763888502 ], [ 0.7789565175724917, 5.4887323564616235, 0.2241886388885022 ], [ 0.7789565175724915, 12.648621908538379, 3.0332603061114978 ] ]
[{"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 ]
[ [ -0.01392571, 0, 0 ], [ 0, -0.57163085, 0.15782856 ], [ 0, 0.15782857, -0.25070704 ] ]
-146.983596
-158.503596
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01185127, 0.00308378, 0.00597306 ], [ -0.01185127, -0.00308378, -0.00597306 ], [ 0.01185127, -0.00308378, -0.00597306 ], [ 0.01185127, 0.00308378, 0.00597306 ], [ 0.00082138, -0.00571112, 0.00392626 ], [ 0.00082138, 0.00571112, -0.00392626 ], [ -0.00082138, 0.00571112, -0.00392626 ], [ -0.00082138, -0.00571112, 0.00392626 ], [ 0.00149536, 0.00487274, -0.00313803 ], [ 0.00149536, -0.00487274, 0.00313803 ], [ -0.00149536, -0.00487274, 0.00313803 ], [ -0.00149536, 0.00487274, -0.00313803 ], [ 0.0046033, -0.02349067, -0.00147473 ], [ 0.0046033, 0.02349067, 0.00147473 ], [ -0.0046033, 0.02349067, 0.00147473 ], [ -0.0046033, -0.02349067, -0.00147473 ], [ -0.00615554, 0.00318015, 0.00273265 ], [ -0.00615554, -0.00318015, -0.00273265 ], [ 0.00615554, -0.00318015, -0.00273265 ], [ 0.00615554, 0.00318015, 0.00273265 ] ]
pbe
true
15
agm005266151-pbe-455
455
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25726468, 7.95262921, 0.08118259 ], [ -3.25726468, 7.95262921, 0.08118259 ], [ 0, 4.46240658, 6.19039899 ] ]
agm005266151
[ [ 1.62863234, 3.976314605, 0.040591295 ], [ -1.62863234, 6.207517895, 3.13579079 ], [ 0.7667579558773112, 4.16328146218939, 2.76584008003002 ], [ 0.7667579558773108, 13.973180247810609, 0.4917245949699801 ], [ -0.7667579558773108, 16.204383537810607, 3.5869240899699806 ], [ -0.7667579558773112, 6.39448475218939, 5.86103957503002 ], [ -2.480343960603148, 11.541096030075582, 4.166126679288512 ], [ -2.480343960603148, 11.057772259924418, 5.281836985711488 ], [ 2.480343960603148, 8.826568969924418, 2.186637490711488 ], [ 2.480343960603148, 9.309892740075583, 1.070927184288512 ], [ -1.8525111771481089, 11.417767023586139, 1.9685712355711744 ], [ -1.8525111771481084, 6.718694686413858, 1.2889934394288258 ], [ 1.8525111771481084, 8.949897976413858, 4.3841929344288255 ], [ 1.8525111771481089, 13.648970313586139, 5.063770730571175 ], [ 0.1856332730361271, 5.258990114238168, 2.5440849066057303 ], [ 0.1856332730361272, 12.877471595761833, 0.7134797683942697 ], [ -0.1856332730361272, 15.108674885761832, 3.80867926339427 ], [ -0.1856332730361271, 7.490193404238168, 5.63928440160573 ], [ -0.7788949475193994, 14.879283581638667, 6.128839952831516 ], [ -0.7788949475193996, 7.71958470836133, 3.3191237121684845 ], [ 0.7788949475193996, 5.488381418361331, 0.22392421716848449 ], [ 0.7788949475193994, 12.648080291638667, 3.033640457831516 ] ]
[{"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 ]
[ [ 0.06546774, 0, 0 ], [ 0, -0.34390132, 0.1791532 ], [ 0, 0.17915313, -0.44660706 ] ]
-146.983631
-158.503631
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00640465, -0.00671753, 0.01258752 ], [ -0.00640465, 0.00671753, -0.01258752 ], [ 0.00640465, 0.00671753, -0.01258752 ], [ 0.00640465, -0.00671753, 0.01258752 ], [ 0.00045932, 0.00285482, -0.01704121 ], [ 0.00045932, -0.00285482, 0.01704121 ], [ -0.00045932, -0.00285482, 0.01704121 ], [ -0.00045932, 0.00285482, -0.01704121 ], [ 0.0009083, 0.00350033, -0.00186279 ], [ 0.0009083, -0.00350033, 0.00186279 ], [ -0.0009083, -0.00350033, 0.00186279 ], [ -0.0009083, 0.00350033, -0.00186279 ], [ -0.00013048, -0.01555407, -0.00189674 ], [ -0.00013048, 0.01555407, 0.00189674 ], [ 0.00013048, 0.01555407, 0.00189674 ], [ 0.00013048, -0.01555407, -0.00189674 ], [ -0.00467331, 0.00091648, 0.00236976 ], [ -0.00467331, -0.00091648, -0.00236976 ], [ 0.00467331, -0.00091648, -0.00236976 ], [ 0.00467331, 0.00091648, 0.00236976 ] ]
pbe
true
15
agm005266151-pbe-456
456
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25726517, 7.95187617, 0.08102295 ], [ -3.25726517, 7.95187617, 0.08102295 ], [ 0, 4.46184853, 6.19150048 ] ]
agm005266151
[ [ 1.628632585, 3.975938085, 0.040511475 ], [ -1.628632585, 6.20686235, 3.1362617150000003 ], [ 0.7663411738538795, 4.1624950843635515, 2.766044248164542 ], [ 0.7663411738538795, 13.972181520636447, 0.4917518918354579 ], [ -0.7663411738538795, 16.20310578563645, 3.587502131835458 ], [ -0.7663411738538795, 6.393419349363551, 5.861794488164543 ], [ -2.4803297086080436, 11.53958507854288, 4.166815185668538 ], [ -2.4803297086080436, 11.05694005645712, 5.282481434331462 ], [ 2.4803297086080436, 8.82601579145712, 2.1867311943314616 ], [ 2.4803297086080436, 9.30866081354288, 1.0710649456685384 ], [ -1.8524898275861383, 11.416600485948102, 1.9685636291899578 ], [ -1.8524898275861383, 6.718076119051899, 1.2892325108100424 ], [ 1.8524898275861383, 8.9490003840519, 4.3849827508100425 ], [ 1.8524898275861383, 13.6475247509481, 5.064313869189958 ], [ 0.1849343895739649, 5.257589148309208, 2.5440947950674504 ], [ 0.1849343895739648, 12.877087456690793, 0.7137013449325499 ], [ -0.1849343895739648, 15.108011721690794, 3.8094515849325497 ], [ -0.1849343895739649, 7.4885134133092075, 5.63984503506745 ], [ -0.778771809776847, 14.87792124273332, 6.130151069381371 ], [ -0.7787718097768471, 7.718603892266682, 3.3191455506186283 ], [ 0.7787718097768471, 5.487679627266682, 0.22339531061862852 ], [ 0.778771809776847, 12.64699697773332, 3.034400829381372 ] ]
[{"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 ]
[ [ 0.24208629, 0, 0 ], [ 0, 0.14073794, 0.21870083 ], [ 0, 0.21870082, -0.81324631 ] ]
-146.983621
-158.503621
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00484773, -0.02585049, 0.02548266 ], [ 0.00484773, 0.02585049, -0.02548266 ], [ -0.00484773, 0.02585049, -0.02548266 ], [ -0.00484773, -0.02585049, 0.02548266 ], [ 0.00025404, 0.02024544, -0.05923532 ], [ 0.00025404, -0.02024544, 0.05923532 ], [ -0.00025404, -0.02024544, 0.05923532 ], [ -0.00025404, 0.02024544, -0.05923532 ], [ 0.00013949, 0.00167088, 0.00080681 ], [ 0.00013949, -0.00167088, -0.00080681 ], [ -0.00013949, -0.00167088, -0.00080681 ], [ -0.00013949, 0.00167088, 0.00080681 ], [ -0.00920777, 0.0007426, -0.00307647 ], [ -0.00920777, -0.0007426, 0.00307647 ], [ 0.00920777, -0.0007426, 0.00307647 ], [ 0.00920777, 0.0007426, -0.00307647 ], [ -0.00116439, -0.00333726, 0.0009109 ], [ -0.00116439, 0.00333726, -0.0009109 ], [ 0.00116439, 0.00333726, -0.0009109 ], [ 0.00116439, -0.00333726, 0.0009109 ] ]
pbe
true
15
agm005266151-pbe-457
457
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25726487, 7.9523425, 0.08112181 ], [ -3.25726487, 7.9523425, 0.08112181 ], [ 0, 4.46219411, 6.19081837 ] ]
agm005266151
[ [ 1.628632435, 3.97617125, 0.040560905 ], [ -1.628632435, 6.207268305, 3.13597009 ], [ 0.7665992740860706, 4.16298204740635, 2.765917800080764 ], [ 0.766599274086071, 13.97280000759365, 0.49173500491923605 ], [ -0.766599274086071, 16.20389706259365, 3.5871441899192362 ], [ -0.7665992740860706, 6.39407910240635, 5.861326985080764 ], [ -2.48033853536154, 11.540520754608629, 4.166388808328997 ], [ -2.4803385353615406, 11.057455410391372, 5.282082366671002 ], [ 2.4803385353615406, 8.826358355391372, 2.1866731816710034 ], [ 2.48033853536154, 9.309423699608628, 1.0709796233289968 ], [ -1.8525030443270982, 11.41732291392924, 1.9685683649690124 ], [ -1.852503044327098, 6.718459141070759, 1.2890844400309875 ], [ 1.852503044327098, 8.949556196070759, 4.384493625030987 ], [ 1.8525030443270982, 13.648419968929241, 5.063977549969013 ], [ 0.18536719789709954, 5.25845675792318, 2.5440886611573763 ], [ 0.18536719789709988, 12.877325297076819, 0.7135641438426237 ], [ -0.18536719789709988, 15.10842235207682, 3.8089733288426233 ], [ -0.18536719789709954, 7.48955381292318, 5.639497846157377 ], [ -0.7788480557664623, 14.878764859629783, 6.129339167626447 ], [ -0.7788480557664622, 7.719211305370218, 3.3191320073735526 ], [ 0.7788480557664622, 5.488114250370217, 0.22372282237355268 ], [ 0.7788480557664623, 12.647667804629783, 3.033929982626447 ] ]
[{"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 ]
[ [ 0.12873008, 0, 0 ], [ 0, -0.16749472, 0.1933142 ], [ 0, 0.19331419, -0.5791121 ] ]
-146.983641
-158.503641
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00211541, -0.01364691, 0.01761931 ], [ -0.00211541, 0.01364691, -0.01761931 ], [ 0.00211541, 0.01364691, -0.01761931 ], [ 0.00211541, -0.01364691, 0.01761931 ], [ 0.00040382, 0.00960077, -0.03326831 ], [ 0.00040382, -0.00960077, 0.03326831 ], [ -0.00040382, -0.00960077, 0.03326831 ], [ -0.00040382, 0.00960077, -0.03326831 ], [ 0.00081704, 0.00278522, -0.00099031 ], [ 0.00081704, -0.00278522, 0.00099031 ], [ -0.00081704, -0.00278522, 0.00099031 ], [ -0.00081704, 0.00278522, -0.00099031 ], [ -0.00406132, -0.00960377, -0.00229723 ], [ -0.00406132, 0.00960377, 0.00229723 ], [ 0.00406132, 0.00960377, 0.00229723 ], [ 0.00406132, -0.00960377, -0.00229723 ], [ -0.00346715, -0.00045789, 0.00192245 ], [ -0.00346715, 0.00045789, -0.00192245 ], [ 0.00346715, 0.00045789, -0.00192245 ], [ 0.00346715, -0.00045789, 0.00192245 ] ]
pbe
true
15
agm005266151-pbe-458
458
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25727623, 7.95214114, 0.08112659 ], [ -3.25727623, 7.95214114, 0.08112659 ], [ 0, 4.46208311, 6.19098827 ] ]
agm005266151
[ [ 1.628638115, 3.97607057, 0.040563295 ], [ -1.628638115, 6.207112125, 3.13605743 ], [ 0.7665037407906657, 4.162763805935083, 2.765993802387799 ], [ 0.7665037407906659, 13.972560029064917, 0.4917535126122013 ], [ -0.7665037407906659, 16.203601584064916, 3.5872476476122017 ], [ -0.7665037407906657, 6.393805360935083, 5.861487937387799 ], [ -2.480342755866399, 11.54018582098917, 4.166436940960263 ], [ -2.4803427558663986, 11.057221124010834, 5.282298644039737 ], [ 2.4803427558663986, 8.826179569010833, 2.186804509039737 ], [ 2.480342755866399, 9.30914426598917, 1.0709428059602633 ], [ -1.8525023065152266, 11.417032781104245, 1.9685923609770533 ], [ -1.8525023065152264, 6.718291053895756, 1.2891549540229468 ], [ 1.8525023065152264, 8.949332608895755, 4.384649089022947 ], [ 1.8525023065152266, 13.648074336104244, 5.064086495977054 ], [ 0.1852016255756186, 5.258108860808454, 2.544071783309953 ], [ 0.1852016255756186, 12.877214974191546, 0.7136755316900465 ], [ -0.1852016255756186, 15.108256529191546, 3.809169666690047 ], [ -0.1852016255756186, 7.489150415808454, 5.639565918309954 ], [ -0.7788338993772324, 14.878428001935902, 6.129615993395448 ], [ -0.7788338993772325, 7.718978943064101, 3.319119591604552 ], [ 0.7788338993772325, 5.487937388064101, 0.2236254566045523 ], [ 0.7788338993772324, 12.6473864469359, 3.034121858395448 ] ]
[{"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 ]
[ [ 0.17536706, 0, 0 ], [ 0, -0.05186092, 0.22140808 ], [ 0, 0.22140806, -0.69287302 ] ]
-146.983662
-158.503662
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00032913, -0.01522871, 0.0149787 ], [ 0.00032913, 0.01522871, -0.0149787 ], [ -0.00032913, 0.01522871, -0.0149787 ], [ -0.00032913, -0.01522871, 0.0149787 ], [ 0.00045435, 0.00435833, -0.02172596 ], [ 0.00045435, -0.00435833, 0.02172596 ], [ -0.00045435, -0.00435833, 0.02172596 ], [ -0.00045435, 0.00435833, -0.02172596 ], [ 0.00087848, 0.00192591, -0.00008727 ], [ 0.00087848, -0.00192591, 0.00008727 ], [ -0.00087848, -0.00192591, 0.00008727 ], [ -0.00087848, 0.00192591, -0.00008727 ], [ -0.00602361, -0.0059504, -0.00245348 ], [ -0.00602361, 0.0059504, 0.00245348 ], [ 0.00602361, 0.0059504, 0.00245348 ], [ 0.00602361, -0.0059504, -0.00245348 ], [ -0.00236531, -0.00160367, 0.00177237 ], [ -0.00236531, 0.00160367, -0.00177237 ], [ 0.00236531, 0.00160367, -0.00177237 ], [ 0.00236531, -0.00160367, 0.00177237 ] ]
pbe
true
15
agm005266151-pbe-459
459
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.51601842, 7.16827045, -0.04027223 ], [ -3.51601842, 7.16827045, -0.04027223 ], [ 0, 3.93836104, 6.08016803 ] ]
agm005266151
[ [ 1.75800921, 3.584135225, -0.020136115 ], [ -1.75800921, 5.553315745, 3.0199479 ], [ 0.792237357236766, 3.746516187926038, 2.676540583036607 ], [ 0.792237357236766, 12.55920523207396, 0.2829989719633928 ], [ -0.792237357236766, 14.52838575207396, 3.323082986963393 ], [ -0.792237357236766, 5.715696707926038, 5.716624598036608 ], [ -2.7024492735285413, 10.35538508027513, 3.9586841314083054 ], [ -2.702449273528541, 9.888697379724869, 5.081023453591695 ], [ 2.702449273528541, 7.919516859724869, 2.0409394385916944 ], [ 2.7024492735285413, 8.38620456027513, 0.9186001164083054 ], [ -2.00554327076134, 10.263813955355836, 1.7858306180085421 ], [ -2.00554327076134, 6.041907464644163, 1.173708936991458 ], [ 2.00554327076134, 8.011087984644163, 4.213792951991458 ], [ 2.00554327076134, 12.232994475355836, 4.8259146330085425 ], [ 0.12432416107941124, 4.782727275626469, 2.416280933983721 ], [ 0.1243241610794108, 11.522994144373532, 0.5432586210162792 ], [ -0.1243241610794108, 13.492174664373533, 3.5833426360162792 ], [ -0.12432416107941124, 6.751907795626469, 5.456364948983722 ], [ -1.061457094486772, 13.106761371103712, 5.809495230805004 ], [ -1.061457094486772, 7.137321088896288, 3.230212354194997 ], [ 1.061457094486772, 5.168140568896288, 0.19012833919499722 ], [ 1.061457094486772, 11.137580851103712, 2.769411215805003 ] ]
[{"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 ]
[ [ 2.27540472, 0, 0 ], [ 0, 3.00346428, -0.37686839 ], [ 0, -0.37686844, 4.35082277 ] ]
-146.829404
-158.349404
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.02141651, 0.00799219, -0.09601698 ], [ 0.02141651, -0.00799219, 0.09601698 ], [ -0.02141651, -0.00799219, 0.09601698 ], [ -0.02141651, 0.00799219, -0.09601698 ], [ 0.01615403, 0.02115573, 0.01641197 ], [ 0.01615403, -0.02115573, -0.01641197 ], [ -0.01615403, -0.02115573, -0.01641197 ], [ -0.01615403, 0.02115573, 0.01641197 ], [ 0.05304801, -0.05496437, 0.05561507 ], [ 0.05304801, 0.05496437, -0.05561507 ], [ -0.05304801, 0.05496437, -0.05561507 ], [ -0.05304801, -0.05496437, 0.05561507 ], [ 0.00706426, 0.01579144, 0.07652717 ], [ 0.00706426, -0.01579144, -0.07652717 ], [ -0.00706426, -0.01579144, -0.07652717 ], [ -0.00706426, 0.01579144, 0.07652717 ], [ 0.028032, -0.01216311, 0.00510142 ], [ 0.028032, 0.01216311, -0.00510142 ], [ -0.028032, 0.01216311, -0.00510142 ], [ -0.028032, -0.01216311, 0.00510142 ] ]
pbe
true
15
agm005266151-pbe-46
46
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.2573103, 7.95153708, 0.08114092 ], [ -3.2573103, 7.95153708, 0.08114092 ], [ 0, 4.46175012, 6.19149797 ] ]
agm005266151
[ [ 1.62865515, 3.97576854, 0.04057046 ], [ -1.62865515, 6.2066436, 3.1363194450000003 ], [ 0.766217069295897, 4.162108966971822, 2.7662218042988593 ], [ 0.7662170692958972, 13.971840253028176, 0.4918090207011408 ], [ -0.7662170692958972, 16.202715313028175, 3.5875580057011414 ], [ -0.766217069295897, 6.392984026971821, 5.8619707892988595 ], [ -2.480355442153947, 11.53918118559422, 4.166581368073768 ], [ -2.480355442153947, 11.05651815440578, 5.282947426926233 ], [ 2.480355442153947, 8.82564309440578, 2.1871984419262334 ], [ 2.480355442153947, 9.30830612559422, 1.0708323830737667 ], [ -1.85250011966424, 11.416162739124282, 1.9686644517316108 ], [ -1.85250011966424, 6.717786480875718, 1.2893663732683895 ], [ 1.85250011966424, 8.948661540875719, 4.38511535826839 ], [ 1.85250011966424, 13.64703779912428, 5.064413436731611 ], [ 0.18470499880702795, 5.2570651678419384, 2.5440211151116117 ], [ 0.18470499880702818, 12.87688405215806, 0.7140097098883883 ], [ -0.18470499880702818, 15.10775911215806, 3.809758694888388 ], [ -0.18470499880702795, 7.487940227841938, 5.639770100111613 ], [ -0.7787913945393989, 14.877417647888425, 6.130446432476584 ], [ -0.7787913945393989, 7.718281692111573, 3.3190823625234156 ], [ 0.7787913945393989, 5.487406632111573, 0.2233333775234156 ], [ 0.7787913945393989, 12.646542587888426, 3.0346974474765847 ] ]
[{"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 ]
[ [ 0.32395424, 0, 0 ], [ 0, 0.29622438, 0.30686699 ], [ 0, 0.30686701, -1.00574136 ] ]
-146.983694
-158.503694
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00740695, -0.01984173, 0.00710085 ], [ 0.00740695, 0.01984173, -0.00710085 ], [ -0.00740695, 0.01984173, -0.00710085 ], [ -0.00740695, -0.01984173, 0.00710085 ], [ 0.00018897, -0.01105808, 0.01312602 ], [ 0.00018897, 0.01105808, -0.01312602 ], [ -0.00018897, 0.01105808, -0.01312602 ], [ -0.00018897, -0.01105808, 0.01312602 ], [ 0.00093854, -0.00129346, 0.00225375 ], [ 0.00093854, 0.00129346, -0.00225375 ], [ -0.00093854, 0.00129346, -0.00225375 ], [ -0.00093854, -0.00129346, 0.00225375 ], [ -0.01221392, 0.00498048, -0.00217253 ], [ -0.01221392, -0.00498048, 0.00217253 ], [ 0.01221392, -0.00498048, 0.00217253 ], [ 0.01221392, 0.00498048, -0.00217253 ], [ 0.00019498, -0.00491464, 0.00065913 ], [ 0.00019498, 0.00491464, -0.00065913 ], [ -0.00019498, 0.00491464, -0.00065913 ], [ -0.00019498, -0.00491464, 0.00065913 ] ]
pbe
true
15
agm005266151-pbe-460
460
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25736873, 7.95140655, 0.08124769 ], [ -3.25736873, 7.95140655, 0.08124769 ], [ 0, 4.46176014, 6.19148584 ] ]
agm005266151
[ [ 1.628684365, 3.975703275, 0.040623845 ], [ -1.628684365, 6.206583345, 3.136366765 ], [ 0.7661525066399435, 4.16185177480808, 2.766278796696433 ], [ 0.7661525066399433, 13.97184139519192, 0.4919595033035669 ], [ -0.7661525066399433, 16.202721465191917, 3.587702423303567 ], [ -0.7661525066399435, 6.392731844808081, 5.862021716696433 ], [ -2.48039387634413, 11.538943234352352, 4.166671571241612 ], [ -2.48039387634413, 11.056510075647648, 5.2830525687583885 ], [ 2.48039387634413, 8.825630005647646, 2.1873096487583883 ], [ 2.48039387634413, 9.308063164352351, 1.0709286512416123 ], [ -1.852520548561475, 11.415992514946216, 1.968768295557872 ], [ -1.852520548561475, 6.717700655053783, 1.2894700044421281 ], [ 1.852520548561475, 8.948580725053784, 4.385212924442128 ], [ 1.852520548561475, 13.646872584946216, 5.064511215557872 ], [ 0.18445814614769085, 5.256787156150286, 2.543950751589923 ], [ 0.18445814614769063, 12.876906013849714, 0.7142875484100772 ], [ -0.18445814614769063, 15.107786083849714, 3.810030468410077 ], [ -0.18445814614769085, 7.487667226150286, 5.639693671589923 ], [ -0.7787849408854439, 14.877274967480474, 6.130700908529801 ], [ -0.7787849408854438, 7.718178342519526, 3.3190232314702 ], [ 0.7787849408854438, 5.487298272519526, 0.2232803114702 ], [ 0.7787849408854439, 12.646394897480475, 3.0349579885298 ] ]
[{"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 ]
[ [ 0.33220955, 0, 0 ], [ 0, 0.28968504, 0.2649201 ], [ 0, 0.26492014, -0.81761112 ] ]
-146.983724
-158.503724
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00574311, -0.01343022, 0.00238506 ], [ 0.00574311, 0.01343022, -0.00238506 ], [ -0.00574311, 0.01343022, -0.00238506 ], [ -0.00574311, -0.01343022, 0.00238506 ], [ 0.00024469, -0.00931056, 0.00935202 ], [ 0.00024469, 0.00931056, -0.00935202 ], [ -0.00024469, 0.00931056, -0.00935202 ], [ -0.00024469, -0.00931056, 0.00935202 ], [ 0.00159556, -0.00268175, 0.00302775 ], [ 0.00159556, 0.00268175, -0.00302775 ], [ -0.00159556, 0.00268175, -0.00302775 ], [ -0.00159556, -0.00268175, 0.00302775 ], [ -0.01057155, 0.00190935, -0.00083322 ], [ -0.01057155, -0.00190935, 0.00083322 ], [ 0.01057155, -0.00190935, 0.00083322 ], [ 0.01057155, 0.00190935, -0.00083322 ], [ 0.00098163, -0.00512939, 0.00034066 ], [ 0.00098163, 0.00512939, -0.00034066 ], [ -0.00098163, 0.00512939, -0.00034066 ], [ -0.00098163, -0.00512939, 0.00034066 ] ]
pbe
true
15
agm005266151-pbe-461
461
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25746742, 7.95118606, 0.08142803 ], [ -3.25746742, 7.95118606, 0.08142803 ], [ 0, 4.46177705, 6.19146535 ] ]
agm005266151
[ [ 1.62873371, 3.97559303, 0.040714015 ], [ -1.62873371, 6.206481555, 3.1364466899999996 ], [ 0.7660434333632227, 4.161417230735543, 2.766375090771495 ], [ 0.7660434333632229, 13.971843414264459, 0.49221364422850505 ], [ -0.7660434333632229, 16.20273193926446, 3.587946319228505 ], [ -0.7660434333632227, 6.392305755735543, 5.862107765771495 ], [ -2.480458895255618, 11.538541155085355, 4.16682385387675 ], [ -2.480458895255618, 11.056496539914644, 5.28323023112325 ], [ 2.480458895255618, 8.825608014914645, 2.18749755612325 ], [ 2.480458895255618, 9.307652630085355, 1.0710911788767496 ], [ -1.8525550782203806, 11.415704903775168, 1.9689437588229508 ], [ -1.852555078220381, 6.717555741224833, 1.289644976177049 ], [ 1.852555078220381, 8.948444266224833, 4.385377651177049 ], [ 1.8525550782203806, 13.646593428775168, 5.06467643382295 ], [ 0.184041208662015, 5.256317504070445, 2.54383178399041 ], [ 0.1840412086620149, 12.876943140929555, 0.7147569510095898 ], [ -0.1840412086620149, 15.107831665929556, 3.8104896260095895 ], [ -0.184041208662015, 7.487206029070445, 5.63956445899041 ], [ -0.7787740069366731, 14.877033918745592, 6.13113061935375 ], [ -0.7787740069366731, 7.718003776254407, 3.318923465646249 ], [ 0.7787740069366731, 5.487115251254407, 0.22319079064624928 ], [ 0.7787740069366731, 12.646145393745591, 3.0353979443537504 ] ]
[{"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 ]
[ [ 0.34589007, 0, 0 ], [ 0, 0.26376482, 0.19774528 ], [ 0, 0.19774523, -0.51965421 ] ]
-146.983763
-158.503763
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00250088, -0.00290929, -0.00564574 ], [ 0.00250088, 0.00290929, 0.00564574 ], [ -0.00250088, 0.00290929, 0.00564574 ], [ -0.00250088, -0.00290929, -0.00564574 ], [ -0.00043149, -0.00626445, 0.00308883 ], [ -0.00043149, 0.00626445, -0.00308883 ], [ 0.00043149, 0.00626445, -0.00308883 ], [ 0.00043149, -0.00626445, 0.00308883 ], [ 0.00186362, -0.00598491, 0.00477774 ], [ 0.00186362, 0.00598491, -0.00477774 ], [ -0.00186362, 0.00598491, -0.00477774 ], [ -0.00186362, -0.00598491, 0.00477774 ], [ -0.00765756, -0.00383729, 0.00184241 ], [ -0.00765756, 0.00383729, -0.00184241 ], [ 0.00765756, 0.00383729, -0.00184241 ], [ 0.00765756, -0.00383729, 0.00184241 ], [ 0.00195347, -0.00616059, 0.00004921 ], [ 0.00195347, 0.00616059, -0.00004921 ], [ -0.00195347, 0.00616059, -0.00004921 ], [ -0.00195347, -0.00616059, 0.00004921 ] ]
pbe
true
15
agm005266151-pbe-462
462
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.2576648, 7.95074507, 0.08178872 ], [ -3.2576648, 7.95074507, 0.08178872 ], [ 0, 4.46181087, 6.19142437 ] ]
agm005266151
[ [ 1.6288324, 3.975372535, 0.04089436 ], [ -1.6288324, 6.20627797, 3.136606545 ], [ 0.7658252301863281, 4.160548246405001, 2.7665675615625704 ], [ 0.7658252301863282, 13.971847328595, 0.4927220634374298 ], [ -0.7658252301863282, 16.202752763595, 3.588434248437429 ], [ -0.7658252301863281, 6.391453681405001, 5.862279746562571 ], [ -2.480588866083744, 11.537737214673824, 4.16712847299393 ], [ -2.480588866083744, 11.056469230326176, 5.28358552200607 ], [ 2.480588866083744, 8.825563795326177, 2.1878733370060695 ], [ 2.480588866083744, 9.306831779673823, 1.0714162879939306 ], [ -1.8526241661889518, 11.415129744104217, 1.9692947025512206 ], [ -1.852624166188952, 6.717265830895781, 1.2899949224487794 ], [ 1.852624166188952, 8.94817126589578, 4.38570710744878 ], [ 1.8526241661889518, 13.646035179104217, 5.0650068875512195 ], [ 0.183207224307536, 5.2553781986552535, 2.543593884370767 ], [ 0.183207224307536, 12.877017376344746, 0.7156957406292332 ], [ -0.183207224307536, 15.107922811344746, 3.8114079256292333 ], [ -0.183207224307536, 7.486283633655253, 5.639306069370766 ], [ -0.7787521327624483, 14.876551920365259, 6.131990157816839 ], [ -0.778752132762448, 7.7176545246347406, 3.3187238371831618 ], [ 0.778752132762448, 5.48674908963474, 0.2230116521831613 ], [ 0.7787521327624483, 12.64564648536526, 3.0362779728168388 ] ]
[{"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 ]
[ [ 0.38439731, 0, 0 ], [ 0, 0.23685106, 0.06013294 ], [ 0, 0.06013288, 0.10572384 ] ]
-146.983783
-158.503783
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00364087, 0.01893824, -0.02193979 ], [ -0.00364087, -0.01893824, 0.02193979 ], [ 0.00364087, -0.01893824, 0.02193979 ], [ 0.00364087, 0.01893824, -0.02193979 ], [ -0.00105551, 0.00007873, -0.00973588 ], [ -0.00105551, -0.00007873, 0.00973588 ], [ 0.00105551, -0.00007873, 0.00973588 ], [ 0.00105551, 0.00007873, -0.00973588 ], [ 0.00323674, -0.01146478, 0.0075089 ], [ 0.00323674, 0.01146478, -0.0075089 ], [ -0.00323674, 0.01146478, -0.0075089 ], [ -0.00323674, -0.01146478, 0.0075089 ], [ -0.00204368, -0.01448737, 0.00682833 ], [ -0.00204368, 0.01448737, -0.00682833 ], [ 0.00204368, 0.01448737, -0.00682833 ], [ 0.00204368, -0.01448737, 0.00682833 ], [ 0.00416897, -0.00734068, -0.00093384 ], [ 0.00416897, 0.00734068, 0.00093384 ], [ -0.00416897, 0.00734068, 0.00093384 ], [ -0.00416897, -0.00734068, -0.00093384 ] ]
pbe
true
15
agm005266151-pbe-463
463
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25760703, 7.95087415, 0.08168315 ], [ -3.25760703, 7.95087415, 0.08168315 ], [ 0, 4.46180097, 6.19143636 ] ]
agm005266151
[ [ 1.628803515, 3.975437075, 0.040841575 ], [ -1.628803515, 6.20633756, 3.136559755 ], [ 0.7658890501203262, 4.160802615573379, 2.7665112152774167 ], [ 0.7658890501203262, 13.97184616942662, 0.4925732647225831 ], [ -0.7658890501203262, 16.20274665442662, 3.588291444722583 ], [ -0.7658890501203262, 6.3917031005733795, 5.862229395277417 ], [ -2.480550805252623, 11.537972573891691, 4.167039291969721 ], [ -2.480550805252623, 11.056477181108308, 5.283481548030279 ], [ 2.480550805252623, 8.825576696108307, 2.1877633680302786 ], [ 2.480550805252623, 9.307072088891692, 1.0713211119697212 ], [ -1.852603952079116, 11.41529814113108, 1.9691919652468937 ], [ -1.8526039520791158, 6.71735064386892, 1.2898925147531062 ], [ 1.8526039520791158, 8.94825112886892, 4.385610694753106 ], [ 1.852603952079116, 13.64619862613108, 5.064910145246894 ], [ 0.18345135806876278, 5.255653169730149, 2.543663536557106 ], [ 0.1834513580687629, 12.876995615269852, 0.715420943442894 ], [ -0.1834513580687629, 15.107896100269851, 3.811139123442894 ], [ -0.18345135806876278, 7.486553654730149, 5.639381716557106 ], [ -0.778758552453044, 14.876693013528536, 6.131738563575762 ], [ -0.778758552453044, 7.717756741471463, 3.318782276424237 ], [ 0.778758552453044, 5.486856256471464, 0.22306409642423689 ], [ 0.778758552453044, 12.645792528528537, 3.036020383575763 ] ]
[{"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 ]
[ [ 0.39575414, 0, 0 ], [ 0, 0.27081581, 0.10143368 ], [ 0, 0.10143372, -0.05583954 ] ]
-146.983783
-158.503783
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00195224, 0.01285469, -0.01729631 ], [ -0.00195224, -0.01285469, 0.01729631 ], [ 0.00195224, -0.01285469, 0.01729631 ], [ 0.00195224, 0.01285469, -0.01729631 ], [ -0.00092656, -0.00166658, -0.00610425 ], [ -0.00092656, 0.00166658, 0.00610425 ], [ 0.00092656, 0.00166658, 0.00610425 ], [ 0.00092656, -0.00166658, -0.00610425 ], [ 0.00301625, -0.00975216, 0.00614788 ], [ 0.00301625, 0.00975216, -0.00614788 ], [ -0.00301625, 0.00975216, -0.00614788 ], [ -0.00301625, -0.00975216, 0.00614788 ], [ -0.00451457, -0.01145648, 0.00538593 ], [ -0.00451457, 0.01145648, -0.00538593 ], [ 0.00451457, 0.01145648, -0.00538593 ], [ 0.00451457, -0.01145648, 0.00538593 ], [ 0.00312953, -0.00643679, -0.00037324 ], [ 0.00312953, 0.00643679, 0.00037324 ], [ -0.00312953, 0.00643679, 0.00037324 ], [ -0.00312953, -0.00643679, -0.00037324 ] ]
pbe
true
15
agm005266151-pbe-464
464
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25778934, 7.95085983, 0.08189516 ], [ -3.25778934, 7.95085983, 0.08189516 ], [ 0, 4.46195812, 6.1914277 ] ]
agm005266151
[ [ 1.62889467, 3.975429915, 0.04094758 ], [ -1.62889467, 6.206408975, 3.13666143 ], [ 0.7658054126760336, 4.160663048599485, 2.7664626333493603 ], [ 0.7658054126760336, 13.972035671400514, 0.49304153665064 ], [ -0.7658054126760336, 16.203014731400515, 3.58875538665064 ], [ -0.7658054126760336, 6.391642108599485, 5.8621764833493595 ], [ -2.48068920426008, 11.537901399233464, 4.167185949289087 ], [ -2.4806892042600794, 11.056755440766537, 5.2837459207109125 ], [ 2.4806892042600794, 8.825776380766536, 2.1880320707109124 ], [ 2.48068920426008, 9.306922339233463, 1.0714720992890874 ], [ -1.8526637169344224, 11.415232041857548, 1.9694721518203635 ], [ -1.8526637169344227, 6.717466678142454, 1.290032018179637 ], [ 1.8526637169344227, 8.948445738142453, 4.3857458681796375 ], [ 1.8526637169344224, 13.646211101857547, 5.065186001820363 ], [ 0.18307228640863504, 5.255295911610587, 2.543641814171262 ], [ 0.1830722864086347, 12.877402808389412, 0.7158623558287383 ], [ -0.1830722864086347, 15.108381868389413, 3.8115762058287386 ], [ -0.18307228640863504, 7.486274971610587, 5.639355664171262 ], [ -0.778746459582889, 14.876800172982426, 6.1321825688745975 ], [ -0.7787464595828893, 7.717856667017573, 3.318749301125403 ], [ 0.7787464595828893, 5.486877607017572, 0.22303545112540202 ], [ 0.778746459582889, 12.645821112982425, 3.0364687188745982 ] ]
[{"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 ]
[ [ 0.40819709, 0, 0 ], [ 0, 0.26807473, 0.05884556 ], [ 0, 0.05884559, 0.07100037 ] ]
-146.983818
-158.503818
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00140609, 0.01135299, -0.01544673 ], [ -0.00140609, -0.01135299, 0.01544673 ], [ 0.00140609, -0.01135299, 0.01544673 ], [ 0.00140609, 0.01135299, -0.01544673 ], [ -0.00100616, -0.00078679, -0.00647348 ], [ -0.00100616, 0.00078679, 0.00647348 ], [ 0.00100616, 0.00078679, 0.00647348 ], [ 0.00100616, -0.00078679, -0.00647348 ], [ 0.00335264, -0.00987822, 0.0044922 ], [ 0.00335264, 0.00987822, -0.0044922 ], [ -0.00335264, 0.00987822, -0.0044922 ], [ -0.00335264, -0.00987822, 0.0044922 ], [ -0.00429162, -0.00846101, 0.00359379 ], [ -0.00429162, 0.00846101, -0.00359379 ], [ 0.00429162, 0.00846101, -0.00359379 ], [ 0.00429162, -0.00846101, 0.00359379 ], [ 0.00346555, -0.00548516, -0.00093463 ], [ 0.00346555, 0.00548516, 0.00093463 ], [ -0.00346555, 0.00548516, 0.00093463 ], [ -0.00346555, -0.00548516, -0.00093463 ] ]
pbe
true
15
agm005266151-pbe-465
465
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25833629, 7.95081686, 0.08253119 ], [ -3.25833629, 7.95081686, 0.08253119 ], [ 0, 4.46242956, 6.19140172 ] ]
agm005266151
[ [ 1.629168145, 3.97540843, 0.041265595 ], [ -1.629168145, 6.20662321, 3.136966455 ], [ 0.7655542571762249, 4.160244188276886, 2.766316784273354 ], [ 0.7655542571762246, 13.972604311723114, 0.4944464557266458 ], [ -0.7655542571762246, 16.203819091723112, 3.5901473157266457 ], [ -0.7655542571762249, 6.391458968276886, 5.8620176442733545 ], [ -2.4811043836439555, 11.537687757507845, 4.167625888239715 ], [ -2.481104383643955, 11.057590302492155, 5.284539071760285 ], [ 2.481104383643955, 8.826375522492155, 2.1888382117602845 ], [ 2.4811043836439555, 9.306472977507845, 1.0719250282397152 ], [ -1.8528429607994523, 11.415033973858238, 1.9703126797186603 ], [ -1.8528429607994523, 6.717814526141762, 1.2904505602813399 ], [ 1.8528429607994523, 8.949029306141762, 4.386151420281339 ], [ 1.8528429607994523, 13.646248753858238, 5.066013539718661 ], [ 0.18193494142402034, 5.25422423754841, 2.5435767264466635 ], [ 0.1819349414240201, 12.87862426245159, 0.7171865135533364 ], [ -0.1819349414240201, 15.10983904245159, 3.8128873735533357 ], [ -0.18193494142402034, 7.48543901754841, 5.6392775864466635 ], [ -0.7787103112809062, 14.877121604837214, 6.133514532575741 ], [ -0.7787103112809064, 7.718156455162785, 3.3186504274242585 ], [ 0.7787103112809064, 5.486941675162785, 0.2229495674242592 ], [ 0.7787103112809062, 12.645906824837214, 3.0378136725757408 ] ]
[{"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 ]
[ [ 0.49972692, 0, 0 ], [ 0, 0.32617328, -0.06384693 ], [ 0, -0.06384698, 0.50191124 ] ]
-146.983889
-158.503889
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00033246, 0.0079698, -0.01006794 ], [ -0.00033246, -0.0079698, 0.01006794 ], [ 0.00033246, -0.0079698, 0.01006794 ], [ 0.00033246, 0.0079698, -0.01006794 ], [ -0.00144565, 0.00193046, -0.00788495 ], [ -0.00144565, -0.00193046, 0.00788495 ], [ 0.00144565, -0.00193046, 0.00788495 ], [ 0.00144565, 0.00193046, -0.00788495 ], [ 0.00476761, -0.01000996, -0.00187329 ], [ 0.00476761, 0.01000996, 0.00187329 ], [ -0.00476761, 0.01000996, 0.00187329 ], [ -0.00476761, -0.01000996, -0.00187329 ], [ -0.00590703, -0.00013092, -0.00158188 ], [ -0.00590703, 0.00013092, 0.00158188 ], [ 0.00590703, 0.00013092, 0.00158188 ], [ 0.00590703, -0.00013092, -0.00158188 ], [ 0.00339493, -0.00135955, -0.00178451 ], [ 0.00339493, 0.00135955, 0.00178451 ], [ -0.00339493, 0.00135955, 0.00178451 ], [ -0.00339493, -0.00135955, -0.00178451 ] ]
pbe
true
15
agm005266151-pbe-466
466
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.2594302, 7.95073092, 0.08380325 ], [ -3.2594302, 7.95073092, 0.08380325 ], [ 0, 4.46337243, 6.19134976 ] ]
agm005266151
[ [ 1.6297151, 3.97536546, 0.041901625 ], [ -1.6297151, 6.207051675, 3.1375765049999997 ], [ 0.7650517616402961, 4.15940638140251, 2.76602496551196 ], [ 0.7650517616402959, 13.97374167359749, 0.4972564144880398 ], [ -0.7650517616402959, 16.20542788859749, 3.59293129448804 ], [ -0.7650517616402961, 6.39109259640251, 5.86169984551196 ], [ -2.481934781307956, 11.537260497832271, 4.168505684034629 ], [ -2.4819347813079564, 11.059259987167728, 5.2861254559653705 ], [ 2.4819347813079564, 8.827573772167728, 2.190450575965371 ], [ 2.481934781307956, 9.305574282832271, 1.0728308040346288 ], [ -1.85320135406471, 11.414637627710281, 1.9719935787744296 ], [ -1.8532013540647103, 6.718510427289718, 1.2912878012255702 ], [ 1.8532013540647103, 8.950196642289718, 4.38696268122557 ], [ 1.85320135406471, 13.64632384271028, 5.067668458774429 ], [ 0.17965946668097998, 5.25208081674513, 2.543446134515261 ], [ 0.1796594666809801, 12.88106723825487, 0.719835245484739 ], [ -0.1796594666809801, 15.112753453254872, 3.815510125484739 ], [ -0.17965946668097998, 7.4837670317451295, 5.63912101451526 ], [ -0.7786378489771442, 14.877764755367414, 6.136178290688137 ], [ -0.778637848977144, 7.718755729632585, 3.3184528493118624 ], [ 0.778637848977144, 5.487069514632585, 0.22277796931186278 ], [ 0.7786378489771442, 12.646078540367414, 3.040503410688137 ] ]
[{"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 ]
[ [ 0.6867563, 0, 0 ], [ 0, 0.44130288, -0.3049164 ], [ 0, -0.30491638, 1.35405547 ] ]
-146.983912
-158.503912
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.0021006, 0.00070527, 0.00078731 ], [ 0.0021006, -0.00070527, -0.00078731 ], [ -0.0021006, -0.00070527, -0.00078731 ], [ -0.0021006, 0.00070527, 0.00078731 ], [ -0.0022795, 0.00713812, -0.01021917 ], [ -0.0022795, -0.00713812, 0.01021917 ], [ 0.0022795, -0.00713812, 0.01021917 ], [ 0.0022795, 0.00713812, -0.01021917 ], [ 0.00751911, -0.01032769, -0.01445562 ], [ 0.00751911, 0.01032769, 0.01445562 ], [ -0.00751911, 0.01032769, 0.01445562 ], [ -0.00751911, -0.01032769, -0.01445562 ], [ -0.00917376, 0.01625115, -0.01218844 ], [ -0.00917376, -0.01625115, 0.01218844 ], [ 0.00917376, -0.01625115, 0.01218844 ], [ 0.00917376, 0.01625115, -0.01218844 ], [ 0.00352707, 0.00679958, -0.00345447 ], [ 0.00352707, -0.00679958, 0.00345447 ], [ -0.00352707, -0.00679958, 0.00345447 ], [ -0.00352707, 0.00679958, -0.00345447 ] ]
pbe
true
15
agm005266151-pbe-467
467
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25901038, 7.9507639, 0.08331506 ], [ -3.25901038, 7.9507639, 0.08331506 ], [ 0, 4.46301057, 6.1913697 ] ]
agm005266151
[ [ 1.62950519, 3.97538195, 0.04165753 ], [ -1.62950519, 6.206887235, 3.13734238 ], [ 0.7652445772361745, 4.159727966516745, 2.7661369836282304 ], [ 0.7652445772361745, 13.973305118483255, 0.49617798637176963 ], [ -0.7652445772361745, 16.204810403483254, 3.591862836371769 ], [ -0.7652445772361745, 6.391233251516745, 5.861821833628231 ], [ -2.4816161142968745, 11.537424509841522, 4.168168035103378 ], [ -2.481616114296874, 11.058619145158477, 5.285516634896623 ], [ 2.481616114296874, 8.827113860158478, 2.1898317848966227 ], [ 2.4816161142968745, 9.305919224841523, 1.0724831851033774 ], [ -1.8530638183477939, 11.41478974431624, 1.9713485129383297 ], [ -1.853063818347794, 6.7182433406837605, 1.2909664570616703 ], [ 1.853063818347794, 8.94974862568376, 4.38665130706167 ], [ 1.8530638183477939, 13.64629502931624, 5.06703336293833 ], [ 0.18053261927926956, 5.252903503925777, 2.543496216754798 ], [ 0.18053261927926956, 12.880129581074222, 0.7188187532452022 ], [ -0.18053261927926956, 15.11163486607422, 3.8145036032452015 ], [ -0.18053261927926956, 7.484408788925778, 5.639181066754798 ], [ -0.7786656382424677, 14.877518015727455, 6.135155931988649 ], [ -0.7786656382424675, 7.718525639272543, 3.318528738011351 ], [ 0.7786656382424675, 5.487020354272543, 0.2228438880113508 ], [ 0.7786656382424677, 12.646012730727456, 3.039471081988649 ] ]
[{"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 ]
[ [ 0.59935711, 0, 0 ], [ 0, 0.38062672, -0.21010409 ], [ 0, -0.21010414, 1.01075781 ] ]
-146.983923
-158.503923
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00105656, 0.00361405, -0.00328896 ], [ 0.00105656, -0.00361405, 0.00328896 ], [ -0.00105656, -0.00361405, 0.00328896 ], [ -0.00105656, 0.00361405, -0.00328896 ], [ -0.00198553, 0.00501799, -0.00931905 ], [ -0.00198553, -0.00501799, 0.00931905 ], [ 0.00198553, -0.00501799, 0.00931905 ], [ 0.00198553, 0.00501799, -0.00931905 ], [ 0.00634012, -0.01043847, -0.0092129 ], [ 0.00634012, 0.01043847, 0.0092129 ], [ -0.00634012, 0.01043847, 0.0092129 ], [ -0.00634012, -0.01043847, -0.0092129 ], [ -0.00783161, 0.00936825, -0.0080526 ], [ -0.00783161, -0.00936825, 0.0080526 ], [ 0.00783161, -0.00936825, 0.0080526 ], [ 0.00783161, 0.00936825, -0.0080526 ], [ 0.00371517, 0.00317532, -0.00267862 ], [ 0.00371517, -0.00317532, 0.00267862 ], [ -0.00371517, -0.00317532, 0.00267862 ], [ -0.00371517, 0.00317532, -0.00267862 ] ]
pbe
true
15
agm005266151-pbe-468
468
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25956569, 7.95109907, 0.08349858 ], [ -3.25956569, 7.95109907, 0.08349858 ], [ 0, 4.46333511, 6.19199166 ] ]
agm005266151
[ [ 1.629782845, 3.975549535, 0.04174929 ], [ -1.629782845, 6.20721709, 3.13774512 ], [ 0.7651659656032844, 4.159649856328481, 2.766237858605024 ], [ 0.7651659656032845, 13.974215838671519, 0.49675513139497623 ], [ -0.7651659656032845, 16.20588339367152, 3.5927509613949766 ], [ -0.7651659656032844, 6.391317411328481, 5.8622336886050235 ], [ -2.4820645173603917, 11.537786641606361, 4.168517041950989 ], [ -2.4820645173603917, 11.059414163393637, 5.286467608049012 ], [ 2.4820645173603917, 8.827746608393637, 2.1904717780490115 ], [ 2.4820645173603917, 9.30611908660636, 1.0725212119509882 ], [ -1.8532180871135595, 11.415005836747454, 1.971671326995015 ], [ -1.8532180871135595, 6.718859858252545, 1.2913216630049849 ], [ 1.8532180871135595, 8.950527413252544, 4.387317493004985 ], [ 1.8532180871135595, 13.646673391747454, 5.067667156995015 ], [ 0.1797734900786372, 5.252573594908242, 2.543526783399761 ], [ 0.17977349007863674, 12.881292100091759, 0.7194662066002392 ], [ -0.17977349007863674, 15.112959655091759, 3.81546203660024 ], [ -0.1797734900786372, 7.484241149908241, 5.639522613399761 ], [ -0.7786510170324128, 14.878272812571359, 6.136271021959241 ], [ -0.7786510170324128, 7.718927992428642, 3.318713628040759 ], [ 0.7786510170324128, 5.487260437428642, 0.22271779804075922 ], [ 0.7786510170324128, 12.646605257571359, 3.040275191959241 ] ]
[{"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 ]
[ [ 0.43211164, 0, 0 ], [ 0, -0.15646012, -0.11978153 ], [ 0, -0.11978157, 0.39718629 ] ]
-146.983967
-158.503967
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00160133, 0.0026919, -0.00793425 ], [ 0.00160133, -0.0026919, 0.00793425 ], [ -0.00160133, -0.0026919, 0.00793425 ], [ -0.00160133, 0.0026919, -0.00793425 ], [ -0.00194706, -0.00742464, 0.02235327 ], [ -0.00194706, 0.00742464, -0.02235327 ], [ 0.00194706, 0.00742464, -0.02235327 ], [ 0.00194706, -0.00742464, 0.02235327 ], [ -0.00042402, -0.00148912, -0.00382864 ], [ -0.00042402, 0.00148912, 0.00382864 ], [ 0.00042402, 0.00148912, 0.00382864 ], [ 0.00042402, -0.00148912, -0.00382864 ], [ -0.00124156, 0.0020474, -0.008487 ], [ -0.00124156, -0.0020474, 0.008487 ], [ 0.00124156, -0.0020474, 0.008487 ], [ 0.00124156, 0.0020474, -0.008487 ], [ 0.00233673, 0.00730816, -0.0030893 ], [ 0.00233673, -0.00730816, 0.0030893 ], [ -0.00233673, -0.00730816, 0.0030893 ], [ -0.00233673, 0.00730816, -0.0030893 ] ]
pbe
true
15
agm005266151-pbe-469
469
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.51527128, 7.16943604, -0.04109247 ], [ -3.51527128, 7.16943604, -0.04109247 ], [ 0, 3.93830617, 6.08025202 ] ]
agm005266151
[ [ 1.75763564, 3.58471802, -0.020546235 ], [ -1.75763564, 5.553871105, 3.019579775 ], [ 0.7925188591992457, 3.7467707789003226, 2.6762022745104974 ], [ 0.7925188591992454, 12.561254386099677, 0.28173879548950226 ], [ -0.7925188591992454, 14.530407471099675, 3.3218648054895024 ], [ -0.7925188591992457, 5.715923863900322, 5.716328284510498 ], [ -2.7017994002673245, 10.356520676582559, 3.9577751827840983 ], [ -2.7017994002673245, 9.889810658417442, 5.080417907215901 ], [ 2.7017994002673245, 7.920657573417442, 2.040291897215901 ], [ 2.7017994002673245, 8.387367591582558, 0.917649172784099 ], [ -2.0047163598270967, 10.265132384324655, 1.7846888007370618 ], [ -2.0047163598270967, 6.042892780675343, 1.1732522692629384 ], [ 2.0047163598270967, 8.012045865675343, 4.213378279262938 ], [ 2.0047163598270967, 12.234285469324655, 4.824814810737061 ], [ 0.1247790536308383, 4.783363488583059, 2.41684807465922 ], [ 0.12477905363083819, 11.524661676416942, 0.5410929953407803 ], [ -0.12477905363083819, 13.493814761416942, 3.5812190053407797 ], [ -0.1247790536308383, 6.752516573583058, 5.456974084659219 ], [ -1.060422218147997, 13.108623297282787, 5.8080535862606775 ], [ -1.0604222181479965, 7.137708037717213, 3.2301395037393226 ], [ 1.0604222181479965, 5.168554952717214, 0.1900134937393228 ], [ 1.060422218147997, 11.139470212282786, 2.7679275762606768 ] ]
[{"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 ]
[ [ 2.18651928, 0, 0 ], [ 0, 2.74356565, -0.19331561 ], [ 0, -0.19331558, 3.83331603 ] ]
-146.829998
-158.349998
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.01830166, 0.00431822, -0.08025543 ], [ 0.01830166, -0.00431822, 0.08025543 ], [ -0.01830166, -0.00431822, 0.08025543 ], [ -0.01830166, 0.00431822, -0.08025543 ], [ 0.01792362, 0.01296258, 0.03252208 ], [ 0.01792362, -0.01296258, -0.03252208 ], [ -0.01792362, -0.01296258, -0.03252208 ], [ -0.01792362, 0.01296258, 0.03252208 ], [ 0.05166824, -0.05095881, 0.05350716 ], [ 0.05166824, 0.05095881, -0.05350716 ], [ -0.05166824, 0.05095881, -0.05350716 ], [ -0.05166824, -0.05095881, 0.05350716 ], [ 0.01003746, 0.01302859, 0.07081913 ], [ 0.01003746, -0.01302859, -0.07081913 ], [ -0.01003746, -0.01302859, -0.07081913 ], [ -0.01003746, 0.01302859, 0.07081913 ], [ 0.02550127, -0.00982414, 0.00511036 ], [ 0.02550127, 0.00982414, -0.00511036 ], [ -0.02550127, 0.00982414, -0.00511036 ], [ -0.02550127, -0.00982414, 0.00511036 ] ]
pbe
true
15
agm005266151-pbe-47
47
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.25970778, 7.95118483, 0.08354554 ], [ -3.25970778, 7.95118483, 0.08354554 ], [ 0, 4.46341815, 6.1921508 ] ]
agm005266151
[ [ 1.62985389, 3.975592415, 0.04177277 ], [ -1.62985389, 6.20730149, 3.1378481700000003 ], [ 0.7651458612786408, 4.1596298218847, 2.766263626311034 ], [ 0.7651458612786408, 13.9744489131153, 0.49690285368896603 ], [ -0.7651458612786408, 16.2061579881153, 3.5929782536889663 ], [ -0.7651458612786408, 6.391338896884699, 5.862339026311034 ], [ -2.482179234180395, 11.537879317091603, 4.168606307888283 ], [ -2.4821792341803954, 11.059617567908397, 5.286710972111717 ], [ 2.4821792341803954, 8.827908492908398, 2.190635572111717 ], [ 2.482179234180395, 9.306170242091603, 1.072530907888283 ], [ -1.8532575389402886, 11.415061116709454, 1.9717539061259035 ], [ -1.8532575389402886, 6.719017618290544, 1.2914125738740967 ], [ 1.8532575389402886, 8.950726693290544, 4.387487973874097 ], [ 1.8532575389402886, 13.646770191709455, 5.067829306125904 ], [ 0.17957925742486802, 5.252489235525228, 2.5435346014271007 ], [ 0.17957925742486802, 12.88158949947477, 0.7196318785728997 ], [ -0.17957925742486802, 15.113298574474772, 3.8157072785729 ], [ -0.17957925742486802, 7.484198310525228, 5.6396100014271004 ], [ -0.7786472775297004, 14.878465906139688, 6.13655630461348 ], [ -0.7786472775297006, 7.71903097886031, 3.318760975386521 ], [ 0.7786472775297006, 5.487321903860311, 0.22268557538652062 ], [ 0.7786472775297004, 12.646756831139689, 3.0404809046134793 ] ]
[{"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 ]
[ [ 0.38128205, 0, 0 ], [ 0, -0.30803249, -0.09738829 ], [ 0, -0.09738829, 0.23188046 ] ]
-146.983969
-158.503969
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00171169, 0.00289891, -0.00904183 ], [ 0.00171169, -0.00289891, 0.00904183 ], [ -0.00171169, -0.00289891, 0.00904183 ], [ -0.00171169, 0.00289891, -0.00904183 ], [ -0.00186104, -0.01061109, 0.0302722 ], [ -0.00186104, 0.01061109, -0.0302722 ], [ 0.00186104, 0.01061109, -0.0302722 ], [ 0.00186104, -0.01061109, 0.0302722 ], [ -0.00194415, 0.0006464, -0.00219688 ], [ -0.00194415, -0.0006464, 0.00219688 ], [ 0.00194415, -0.0006464, 0.00219688 ], [ 0.00194415, 0.0006464, -0.00219688 ], [ -0.00037318, -0.00060295, -0.00895301 ], [ -0.00037318, 0.00060295, 0.00895301 ], [ 0.00037318, 0.00060295, 0.00895301 ], [ 0.00037318, -0.00060295, -0.00895301 ], [ 0.00246853, 0.0080321, -0.00296551 ], [ 0.00246853, -0.0080321, 0.00296551 ], [ -0.00246853, -0.0080321, 0.00296551 ], [ -0.00246853, 0.0080321, -0.00296551 ] ]
pbe
true
15
agm005266151-pbe-470
470
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26030828, 7.95123666, 0.08363112 ], [ -3.26030828, 7.95123666, 0.08363112 ], [ 0, 4.46350722, 6.19278547 ] ]
agm005266151
[ [ 1.63015414, 3.97561833, 0.04181556 ], [ -1.63015414, 6.20737194, 3.1382082949999996 ], [ 0.7651244849095594, 4.159443224846671, 2.766276850910704 ], [ 0.7651244849095593, 13.974783705153328, 0.49737812408929616 ], [ -0.7651244849095593, 16.206537315153327, 3.593770859089296 ], [ -0.7651244849095594, 6.391196834846671, 5.862669585910703 ], [ -2.4826785566516723, 11.537695370681792, 4.169217272970736 ], [ -2.4826785566516723, 11.060038779318209, 5.287223172029264 ], [ 2.4826785566516723, 8.828285169318207, 2.190830437029263 ], [ 2.4826785566516723, 9.305941760681792, 1.0728245379707366 ], [ -1.853480203702166, 11.414895820191981, 1.971946168602111 ], [ -1.853480203702166, 6.719331109808019, 1.291708806397889 ], [ 1.853480203702166, 8.95108471980802, 4.388101541397889 ], [ 1.853480203702166, 13.646649430191982, 5.06833890360211 ], [ 0.1789254575817376, 5.252017068710022, 2.543472717751776 ], [ 0.1789254575817374, 12.882209861289978, 0.7201822572482237 ], [ -0.1789254575817374, 15.113963471289978, 3.8165749922482233 ], [ -0.1789254575817376, 7.483770678710023, 5.639865452751776 ], [ -0.7786368977821849, 14.878702961569008, 6.137486075244205 ], [ -0.7786368977821851, 7.719031188430995, 3.318954369755794 ], [ 0.7786368977821851, 5.487277578430994, 0.2225616347557943 ], [ 0.7786368977821849, 12.646949351569006, 3.0410933402442053 ] ]
[{"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 ]
[ [ 0.24780156, 0, 0 ], [ 0, -0.63997503, -0.12618218 ], [ 0, -0.12618231, -0.01929976 ] ]
-146.983999
-158.503999
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00145343, -0.00292758, -0.0006914 ], [ 0.00145343, 0.00292758, 0.0006914 ], [ -0.00145343, 0.00292758, 0.0006914 ], [ -0.00145343, -0.00292758, -0.0006914 ], [ -0.00168905, 0.00847681, -0.01213467 ], [ -0.00168905, -0.00847681, 0.01213467 ], [ 0.00168905, -0.00847681, 0.01213467 ], [ 0.00168905, 0.00847681, -0.01213467 ], [ -0.00737551, 0.00806756, 0.00250842 ], [ -0.00737551, -0.00806756, -0.00250842 ], [ 0.00737551, -0.00806756, -0.00250842 ], [ 0.00737551, 0.00806756, 0.00250842 ], [ 0.00542815, -0.00683228, -0.00844865 ], [ 0.00542815, 0.00683228, 0.00844865 ], [ -0.00542815, 0.00683228, 0.00844865 ], [ -0.00542815, -0.00683228, -0.00844865 ], [ 0.0017015, 0.01010703, -0.00375461 ], [ 0.0017015, -0.01010703, 0.00375461 ], [ -0.0017015, -0.01010703, 0.00375461 ], [ -0.0017015, 0.01010703, -0.00375461 ] ]
pbe
true
15
agm005266151-pbe-471
471
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26026933, 7.9512333, 0.08362557 ], [ -3.26026933, 7.9512333, 0.08362557 ], [ 0, 4.46350145, 6.1927443 ] ]
agm005266151
[ [ 1.630134665, 3.97561665, 0.041812785 ], [ -1.630134665, 6.2073673750000005, 3.138184935 ], [ 0.7651258748491939, 4.159455348167428, 2.766275998740996 ], [ 0.7651258748491938, 13.974761976832573, 0.4973472912590046 ], [ -0.7651258748491938, 16.206512701832573, 3.5937194412590046 ], [ -0.7651258748491939, 6.391206073167427, 5.862648148740996 ], [ -2.4826461581523565, 11.537707199002774, 4.16917759781809 ], [ -2.4826461581523565, 11.060011575997226, 5.2871899921819105 ], [ 2.4826461581523565, 8.828260850997225, 2.1908178421819104 ], [ 2.4826461581523565, 9.305956474002775, 1.07280544781809 ], [ -1.853465754923157, 11.414906503921939, 1.9719336700437111 ], [ -1.853465754923157, 6.719310821078061, 1.291689619956289 ], [ 1.853465754923157, 8.95106154607806, 4.388061769956289 ], [ 1.853465754923157, 13.64665722892194, 5.068305820043712 ], [ 0.1789678878905947, 5.2520476821400885, 2.543476746233071 ], [ 0.17896788789059448, 12.88216964285991, 0.7201465437669291 ], [ -0.17896788789059448, 15.11392036785991, 3.8165186937669295 ], [ -0.1789678878905947, 7.483798407140089, 5.639848896233071 ], [ -0.7786376046496728, 14.878687665579388, 6.137425817843874 ], [ -0.7786376046496728, 7.719031109420612, 3.3189417721561267 ], [ 0.7786376046496728, 5.487280384420613, 0.22256962215612663 ], [ 0.7786376046496728, 12.646936940579389, 3.0410536678438733 ] ]
[{"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 ]
[ [ 0.24825478, 0, 0 ], [ 0, -0.62766318, -0.12553874 ], [ 0, -0.12553876, -0.00840619 ] ]
-146.983999
-158.503999
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00153986, -0.0023861, -0.00129165 ], [ 0.00153986, 0.0023861, 0.00129165 ], [ -0.00153986, 0.0023861, 0.00129165 ], [ -0.00153986, -0.0023861, -0.00129165 ], [ -0.00160805, 0.00740431, -0.00958036 ], [ -0.00160805, -0.00740431, 0.00958036 ], [ 0.00160805, -0.00740431, 0.00958036 ], [ 0.00160805, 0.00740431, -0.00958036 ], [ -0.00693455, 0.00782324, 0.00231262 ], [ -0.00693455, -0.00782324, -0.00231262 ], [ 0.00693455, -0.00782324, -0.00231262 ], [ 0.00693455, 0.00782324, 0.00231262 ], [ 0.00575033, -0.00611033, -0.00816732 ], [ 0.00575033, 0.00611033, 0.00816732 ], [ -0.00575033, 0.00611033, 0.00816732 ], [ -0.00575033, -0.00611033, -0.00816732 ], [ 0.00177075, 0.00976589, -0.00404915 ], [ 0.00177075, -0.00976589, 0.00404915 ], [ -0.00177075, -0.00976589, 0.00404915 ], [ -0.00177075, 0.00976589, -0.00404915 ] ]
pbe
true
15
agm005266151-pbe-472
472
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26066899, 7.95078302, 0.08357601 ], [ -3.26066899, 7.95078302, 0.08357601 ], [ 0, 4.46320711, 6.19302636 ] ]
agm005266151
[ [ 1.630334495, 3.97539151, 0.041788005 ], [ -1.630334495, 6.206995065, 3.138301185 ], [ 0.7651488134402293, 4.159047207288334, 2.7662173230738123 ], [ 0.7651488134402293, 13.974122387711665, 0.4974478769261877 ], [ -0.7651488134402293, 16.205725942711666, 3.593961056926188 ], [ -0.7651488134402293, 6.390650762288334, 5.862730503073813 ], [ -2.4829900777649985, 11.536944423327814, 4.1692623318317334 ], [ -2.482990077764999, 11.059432281672187, 5.287429228168268 ], [ 2.482990077764999, 8.827828726672188, 2.190916048168267 ], [ 2.4829900777649985, 9.305340868327814, 1.0727491518317331 ], [ -1.8537025809304024, 11.414192011397247, 1.9719227375067883 ], [ -1.8537025809304026, 6.718977583602755, 1.2917424624932117 ], [ 1.8537025809304026, 8.950581138602756, 4.388255642493212 ], [ 1.8537025809304024, 13.645795566397247, 5.068435917506788 ], [ 0.178682084723498, 5.251384092371204, 2.5432921128194437 ], [ 0.17868208472349778, 12.881785502628796, 0.7203730871805561 ], [ -0.17868208472349778, 15.113389057628797, 3.816886267180556 ], [ -0.178682084723498, 7.482987647371204, 5.639805292819444 ], [ -0.7786318101406389, 14.87795168835249, 6.137698453590837 ], [ -0.778631810140639, 7.718425016647512, 3.3189931064091627 ], [ 0.778631810140639, 5.486821461647511, 0.2224799264091627 ], [ 0.7786318101406389, 12.646348133352488, 3.0411852735908376 ] ]
[{"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 ]
[ [ 0.30582292, 0, 0 ], [ 0, -0.47113929, -0.01758456 ], [ 0, -0.01758457, -0.16617574 ] ]
-146.984028
-158.504028
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00058925, -0.00433621, 0.00402795 ], [ 0.00058925, 0.00433621, -0.00402795 ], [ -0.00058925, 0.00433621, -0.00402795 ], [ -0.00058925, -0.00433621, 0.00402795 ], [ -0.00114629, 0.0062308, -0.00682495 ], [ -0.00114629, -0.0062308, 0.00682495 ], [ 0.00114629, -0.0062308, 0.00682495 ], [ 0.00114629, 0.0062308, -0.00682495 ], [ -0.00469978, 0.00595028, -0.00037274 ], [ -0.00469978, -0.00595028, 0.00037274 ], [ 0.00469978, -0.00595028, 0.00037274 ], [ 0.00469978, 0.00595028, -0.00037274 ], [ 0.00328785, -0.0029938, -0.00830102 ], [ 0.00328785, 0.0029938, 0.00830102 ], [ -0.00328785, 0.0029938, 0.00830102 ], [ -0.00328785, -0.0029938, -0.00830102 ], [ 0.00290686, 0.00826428, -0.00422101 ], [ 0.00290686, -0.00826428, 0.00422101 ], [ -0.00290686, -0.00826428, 0.00422101 ], [ -0.00290686, 0.00826428, -0.00422101 ] ]
pbe
true
15
agm005266151-pbe-473
473
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26186797, 7.94943218, 0.08342732 ], [ -3.26186797, 7.94943218, 0.08342732 ], [ 0, 4.4623241, 6.19387253 ] ]
agm005266151
[ [ 1.630933985, 3.97471609, 0.04171366 ], [ -1.630933985, 6.205878139999999, 3.138649925 ], [ 0.765217688091392, 4.157822942397406, 2.7660411374382243 ], [ 0.7652176880913921, 13.972203467602593, 0.4977497675617754 ], [ -0.7652176880913921, 16.20336551760259, 3.5946860325617753 ], [ -0.765217688091392, 6.388984992397407, 5.862977402438226 ], [ -2.4840218295880336, 11.534656321395138, 4.169516496089958 ], [ -2.4840218295880345, 11.057694188604863, 5.2881469389100415 ], [ 2.4840218295880345, 8.826532138604863, 2.191210673910042 ], [ 2.4840218295880336, 9.303494271395138, 1.0725802310899584 ], [ -1.8544130731001016, 11.412048373611809, 1.971889845057055 ], [ -1.8544130731001016, 6.717978036388191, 1.291901059942945 ], [ 1.8544130731001016, 8.94914008638819, 4.388837324942944 ], [ 1.8544130731001016, 13.643210423611809, 5.0688261100570555 ], [ 0.1778243530579966, 5.249393268757327, 2.5427380614051835 ], [ 0.17782435305799682, 12.880633141242672, 0.721052843594816 ], [ -0.17782435305799682, 15.11179519124267, 3.817989108594816 ], [ -0.1778243530579966, 7.480555318757327, 5.639674326405185 ], [ -0.7786143103189007, 14.875743785524502, 6.138516427291492 ], [ -0.7786143103189009, 7.716606724475497, 3.319147007708508 ], [ 0.7786143103189009, 5.485444674475497, 0.2222107427085076 ], [ 0.7786143103189007, 12.644581735524504, 3.0415801622914924 ] ]
[{"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 ]
[ [ 0.39249881, 0, 0 ], [ 0, -0.12823133, 0.30550033 ], [ 0, 0.30550029, -0.72467574 ] ]
-146.984068
-158.504068
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00251946, -0.01058342, 0.02037418 ], [ -0.00251946, 0.01058342, -0.02037418 ], [ 0.00251946, 0.01058342, -0.02037418 ], [ 0.00251946, -0.01058342, 0.02037418 ], [ -0.0001954, 0.00264638, 0.00130161 ], [ -0.0001954, -0.00264638, -0.00130161 ], [ 0.0001954, -0.00264638, -0.00130161 ], [ 0.0001954, 0.00264638, 0.00130161 ], [ 0.0016985, -0.00050964, -0.00708755 ], [ 0.0016985, 0.00050964, 0.00708755 ], [ -0.0016985, 0.00050964, 0.00708755 ], [ -0.0016985, -0.00050964, -0.00708755 ], [ -0.00268604, 0.00617625, -0.0079436 ], [ -0.00268604, -0.00617625, 0.0079436 ], [ 0.00268604, -0.00617625, 0.0079436 ], [ 0.00268604, 0.00617625, -0.0079436 ], [ 0.00608405, 0.00212199, -0.00508225 ], [ 0.00608405, -0.00212199, 0.00508225 ], [ -0.00608405, -0.00212199, 0.00508225 ], [ -0.00608405, 0.00212199, -0.00508225 ] ]
pbe
true
15
agm005266151-pbe-474
474
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26233614, 7.94893349, 0.08352962 ], [ -3.26233614, 7.94893349, 0.08352962 ], [ 0, 4.46212309, 6.19394723 ] ]
agm005266151
[ [ 1.63116807, 3.974466745, 0.04176481 ], [ -1.63116807, 6.20552829, 3.138738425 ], [ 0.76524129485559, 4.157373643668742, 2.7660807065363566 ], [ 0.7652412948555898, 13.971554881331258, 0.49795214846364333 ], [ -0.7652412948555898, 16.20261642633126, 3.594925763463644 ], [ -0.76524129485559, 6.388435188668742, 5.863054321536357 ], [ -2.4844179941248754, 11.533923884792578, 4.169639527423141 ], [ -2.484417994124875, 11.057127730207421, 5.288340557576859 ], [ 2.484417994124875, 8.826066185207422, 2.191366942576859 ], [ 2.4844179941248754, 9.30286233979258, 1.0726659124231408 ], [ -1.854676656403175, 11.411298809769725, 1.9719601037785586 ], [ -1.8546766564031747, 6.7176297152302755, 1.2920727512214414 ], [ 1.8546766564031747, 8.948691260230277, 4.389046366221442 ], [ 1.854676656403175, 13.642360354769725, 5.068933718778559 ], [ 0.17753323351946704, 5.248801159064193, 2.5424884480144048 ], [ 0.17753323351946726, 12.880127365935808, 0.7215444069855951 ], [ -0.17753323351946726, 15.111188910935809, 3.8185180219855956 ], [ -0.17753323351946704, 7.4798627040641925, 5.639462063014405 ], [ -0.7785853914858392, 14.875044582374922, 6.138750790286114 ], [ -0.778585391485839, 7.716007032625078, 3.3192292947138866 ], [ 0.778585391485839, 5.484945487625078, 0.2222556797138864 ], [ 0.7785853914858392, 12.643983037374923, 3.0417771752861134 ] ]
[{"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 ]
[ [ 0.36183896, 0, 0 ], [ 0, -0.1069221, 0.29133994 ], [ 0, 0.29133993, -0.70880393 ] ]
-146.984102
-158.504102
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00387003, -0.00602022, 0.01410906 ], [ -0.00387003, 0.00602022, -0.01410906 ], [ 0.00387003, 0.00602022, -0.01410906 ], [ 0.00387003, -0.00602022, 0.01410906 ], [ 0.00007689, 0.0015752, 0.00322599 ], [ 0.00007689, -0.0015752, -0.00322599 ], [ -0.00007689, -0.0015752, -0.00322599 ], [ -0.00007689, 0.0015752, 0.00322599 ], [ 0.00155143, -0.00156322, -0.00437313 ], [ 0.00155143, 0.00156322, 0.00437313 ], [ -0.00155143, 0.00156322, 0.00437313 ], [ -0.00155143, -0.00156322, -0.00437313 ], [ -0.00152247, 0.00330109, -0.00519208 ], [ -0.00152247, -0.00330109, 0.00519208 ], [ 0.00152247, -0.00330109, 0.00519208 ], [ 0.00152247, 0.00330109, -0.00519208 ], [ 0.00671213, 0.00028546, -0.00491901 ], [ 0.00671213, -0.00028546, 0.00491901 ], [ -0.00671213, -0.00028546, 0.00491901 ], [ -0.00671213, 0.00028546, -0.00491901 ] ]
pbe
true
15
agm005266151-pbe-475
475
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26374064, 7.94743743, 0.08383652 ], [ -3.26374064, 7.94743743, 0.08383652 ], [ 0, 4.46152007, 6.19417131 ] ]
agm005266151
[ [ 1.63187032, 3.973718715, 0.04191826 ], [ -1.63187032, 6.20447875, 3.139003915 ], [ 0.7653120295933071, 4.156025875275169, 2.766199307878685 ], [ 0.7653120295933071, 13.96960901972483, 0.49855938712131487 ], [ -0.7653120295933071, 16.20036905472483, 3.5956450421213146 ], [ -0.7653120295933071, 6.38678591027517, 5.863284962878685 ], [ -2.4856066136535757, 11.531726791547198, 4.170008599316927 ], [ -2.485606613653576, 11.0554281734528, 5.288921405683072 ], [ 2.485606613653576, 8.8246681384528, 2.1918357506830723 ], [ 2.4856066136535757, 9.300966756547199, 1.0729229443169273 ], [ -1.8554672656394222, 11.40905023436589, 1.9721707401031665 ], [ -1.8554672656394222, 6.716584660634108, 1.2925879548968335 ], [ 1.8554672656394222, 8.947344695634108, 4.389673609896834 ], [ 1.8554672656394222, 13.639810269365892, 5.069256395103166 ], [ 0.17665949226266886, 5.247024861591412, 2.541739664775626 ], [ 0.17665949226266875, 12.878610033408588, 0.7230190302243737 ], [ -0.17665949226266875, 15.10937006840859, 3.820104685224374 ], [ -0.17665949226266886, 7.477784896591412, 5.638825319775626 ], [ -0.7784984556262866, 14.872946995678166, 6.139453824640132 ], [ -0.7784984556262864, 7.714207969321834, 3.319476180359868 ], [ 0.7784984556262864, 5.483447934321834, 0.22239052535986792 ], [ 0.7784984556262866, 12.642186960678167, 3.042368169640132 ] ]
[{"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 ]
[ [ 0.27150092, 0, 0 ], [ 0, -0.06983766, 0.24901446 ], [ 0, 0.24901456, -0.67070981 ] ]
-146.98416
-158.50416
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.0084219, 0.00862221, -0.0054616 ], [ -0.0084219, -0.00862221, 0.0054616 ], [ 0.0084219, -0.00862221, 0.0054616 ], [ 0.0084219, 0.00862221, -0.0054616 ], [ 0.0006773, -0.00129316, 0.00840288 ], [ 0.0006773, 0.00129316, -0.00840288 ], [ -0.0006773, 0.00129316, -0.00840288 ], [ -0.0006773, -0.00129316, 0.00840288 ], [ 0.0011306, -0.00444829, 0.00369335 ], [ 0.0011306, 0.00444829, -0.00369335 ], [ -0.0011306, 0.00444829, -0.00369335 ], [ -0.0011306, -0.00444829, 0.00369335 ], [ 0.00114409, -0.00630048, 0.00200491 ], [ 0.00114409, 0.00630048, -0.00200491 ], [ -0.00114409, 0.00630048, -0.00200491 ], [ -0.00114409, -0.00630048, 0.00200491 ], [ 0.00875155, -0.00510122, -0.00487061 ], [ 0.00875155, 0.00510122, 0.00487061 ], [ -0.00875155, 0.00510122, 0.00487061 ], [ -0.00875155, -0.00510122, -0.00487061 ] ]
pbe
true
15
agm005266151-pbe-476
476
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26438064, 7.94675571, 0.08397637 ], [ -3.26438064, 7.94675571, 0.08397637 ], [ 0, 4.46124529, 6.19427342 ] ]
agm005266151
[ [ 1.63219032, 3.973377855, 0.041988185 ], [ -1.63219032, 6.204000499999999, 3.139124895 ], [ 0.7653442585594032, 4.155411677636895, 2.7662533551450537 ], [ 0.7653442585594035, 13.968722387363105, 0.4988360948549465 ], [ -0.7653442585594035, 16.199345032363105, 3.595972804854947 ], [ -0.7653442585594032, 6.386034322636895, 5.863390065145054 ], [ -2.4861482149481997, 11.530725619979654, 4.1701767640965555 ], [ -2.4861482149481997, 11.054653735020345, 5.289186105903444 ], [ 2.4861482149481997, 8.824031090020345, 2.1920493959034437 ], [ 2.4861482149481997, 9.300102974979653, 1.073040054096556 ], [ -1.855827553486925, 11.408025669437844, 1.972266767615825 ], [ -1.8558275534869249, 6.716108395562156, 1.2928226823841753 ], [ 1.8558275534869249, 8.946731040562156, 4.389959392384176 ], [ 1.855827553486925, 13.638648314437845, 5.0694034776158245 ], [ 0.17626127725860485, 5.246215549126779, 2.5413984412181625 ], [ 0.17626127725860474, 12.87791851587322, 0.7236910087818378 ], [ -0.17626127725860474, 15.10854116087322, 3.820827718781838 ], [ -0.17626127725860485, 7.476838194126779, 5.6385351512181625 ], [ -0.7784587772053777, 14.871991240547423, 6.139774223656334 ], [ -0.7784587772053776, 7.7133881144525756, 3.3195886463436657 ], [ 0.7784587772053776, 5.482765469452575, 0.2224519363436655 ], [ 0.7784587772053777, 12.641368595547423, 3.0426375136563344 ] ]
[{"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 ]
[ [ 0.22212065, 0, 0 ], [ 0, -0.04933726, 0.22992055 ], [ 0, 0.22992062, -0.65575099 ] ]
-146.984166
-158.504166
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01030423, 0.01492867, -0.01416168 ], [ -0.01030423, -0.01492867, 0.01416168 ], [ 0.01030423, -0.01492867, 0.01416168 ], [ 0.01030423, 0.01492867, -0.01416168 ], [ 0.001048, -0.00273253, 0.01100385 ], [ 0.001048, 0.00273253, -0.01100385 ], [ -0.001048, 0.00273253, -0.01100385 ], [ -0.001048, -0.00273253, 0.01100385 ], [ 0.00090339, -0.00591755, 0.00767209 ], [ 0.00090339, 0.00591755, -0.00767209 ], [ -0.00090339, 0.00591755, -0.00767209 ], [ -0.00090339, -0.00591755, 0.00767209 ], [ 0.00290755, -0.01030569, 0.00559469 ], [ 0.00290755, 0.01030569, -0.00559469 ], [ -0.00290755, 0.01030569, -0.00559469 ], [ -0.00290755, -0.01030569, 0.00559469 ], [ 0.00981166, -0.00787229, -0.00474036 ], [ 0.00981166, 0.00787229, 0.00474036 ], [ -0.00981166, 0.00787229, 0.00474036 ], [ -0.00981166, -0.00787229, -0.00474036 ] ]
pbe
true
15
agm005266151-pbe-477
477
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26505582, 7.94606309, 0.08422809 ], [ -3.26505582, 7.94606309, 0.08422809 ], [ 0, 4.46105368, 6.19417726 ] ]
agm005266151
[ [ 1.63252791, 3.973031545, 0.042114045 ], [ -1.63252791, 6.203558385, 3.139202675 ], [ 0.7653132813378313, 4.154943993841866, 2.766149667341242 ], [ 0.7653132813378312, 13.967709026158134, 0.4993951426587582 ], [ -0.7653132813378312, 16.198235866158136, 3.5964837726587584 ], [ -0.7653132813378313, 6.385470833841866, 5.863238297341242 ], [ -2.4867081419737054, 11.529749546828386, 4.170414911213203 ], [ -2.486708141973705, 11.053957153171613, 5.289307158786797 ], [ 2.486708141973705, 8.823430313171613, 2.192218528786797 ], [ 2.4867081419737054, 9.299222706828386, 1.073326281213203 ], [ -1.8562014078636133, 11.406971582720619, 1.9725016655954914 ], [ -1.856201407863613, 6.7156814372793825, 1.2930431444045087 ], [ 1.856201407863613, 8.946208277279382, 4.390131774404509 ], [ 1.8562014078636133, 13.637498422720618, 5.069590295595491 ], [ 0.17589384641382844, 5.24536913232288, 2.5410738992765993 ], [ 0.17589384641382821, 12.877283887677118, 0.7244709107234008 ], [ -0.17589384641382821, 15.10781072767712, 3.8215595407234004 ], [ -0.17589384641382844, 7.4758959723228795, 5.638162529276599 ], [ -0.7783610647551571, 14.871041568299965, 6.140015334903043 ], [ -0.7783610647551569, 7.712665131700033, 3.319706735096957 ], [ 0.7783610647551569, 5.482138291700034, 0.22261810509695729 ], [ 0.7783610647551571, 12.640514728299966, 3.0429267049030426 ] ]
[{"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 ]
[ [ 0.23186843, 0, 0 ], [ 0, 0.15115942, 0.10298854 ], [ 0, 0.1029886, -0.43370592 ] ]
-146.984198
-158.504198
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00711528, 0.01025601, -0.01415678 ], [ -0.00711528, -0.01025601, 0.01415678 ], [ 0.00711528, -0.01025601, 0.01415678 ], [ 0.00711528, 0.01025601, -0.01415678 ], [ 0.00106262, 0.00499658, -0.00793628 ], [ 0.00106262, -0.00499658, 0.00793628 ], [ -0.00106262, -0.00499658, 0.00793628 ], [ -0.00106262, 0.00499658, -0.00793628 ], [ 0.00080898, -0.0065127, 0.00854592 ], [ 0.00080898, 0.0065127, -0.00854592 ], [ -0.00080898, 0.0065127, -0.00854592 ], [ -0.00080898, -0.0065127, 0.00854592 ], [ -0.00060989, -0.00502104, 0.00541361 ], [ -0.00060989, 0.00502104, -0.00541361 ], [ 0.00060989, 0.00502104, -0.00541361 ], [ 0.00060989, -0.00502104, 0.00541361 ], [ 0.00965188, -0.00879437, -0.00430689 ], [ 0.00965188, 0.00879437, 0.00430689 ], [ -0.00965188, 0.00879437, 0.00430689 ], [ -0.00965188, -0.00879437, -0.00430689 ] ]
pbe
true
15
agm005266151-pbe-478
478
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26537371, 7.945737, 0.0843466 ], [ -3.26537371, 7.945737, 0.0843466 ], [ 0, 4.46096347, 6.19413199 ] ]
agm005266151
[ [ 1.632686855, 3.9728685, 0.0421733 ], [ -1.632686855, 6.203350235, 3.139239295 ], [ 0.7652987138204348, 4.154723806189724, 2.766100860269004 ], [ 0.7652987138204348, 13.967231928810277, 0.49965833473099597 ], [ -0.7652987138204348, 16.197713663810276, 3.596724329730996 ], [ -0.7652987138204348, 6.385205541189724, 5.863166855269005 ], [ -2.4869717698635516, 11.52928997180168, 4.170526993693524 ], [ -2.4869717698635516, 11.053629233198322, 5.289364191306476 ], [ 2.4869717698635516, 8.823147498198322, 2.1922981963064756 ], [ 2.4869717698635516, 9.29880823680168, 1.0734609986935237 ], [ -1.8563774931700463, 11.406475280270543, 1.9726122554151417 ], [ -1.8563774931700465, 6.715480454729458, 1.2931469395848583 ], [ 1.8563774931700465, 8.945962189729459, 4.390212934584858 ], [ 1.8563774931700463, 13.636957015270543, 5.069678250415141 ], [ 0.17572082895197683, 5.244970620568043, 2.540921097772872 ], [ 0.17572082895197694, 12.876985114431958, 0.7248380972271278 ], [ -0.17572082895197694, 15.107466849431958, 3.8219040922271277 ], [ -0.17572082895197683, 7.475452355568043, 5.637987092772873 ], [ -0.7783149832345511, 14.8705944320959, 6.140128841330025 ], [ -0.7783149832345513, 7.712324772904103, 3.319762343669974 ], [ 0.7783149832345513, 5.4818430379041025, 0.22269634866997431 ], [ 0.7783149832345511, 12.6401126970959, 3.0430628463300256 ] ]
[{"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 ]
[ [ 0.27242269, 0, 0 ], [ 0, 0.28490052, 0.04197915 ], [ 0, 0.04197914, -0.29157109 ] ]
-146.984208
-158.504208
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00549952, 0.0084295, -0.01431991 ], [ -0.00549952, -0.0084295, 0.01431991 ], [ 0.00549952, -0.0084295, 0.01431991 ], [ 0.00549952, 0.0084295, -0.01431991 ], [ 0.00122098, 0.00874382, -0.01697932 ], [ 0.00122098, -0.00874382, 0.01697932 ], [ -0.00122098, -0.00874382, 0.01697932 ], [ -0.00122098, 0.00874382, -0.01697932 ], [ 0.00095221, -0.00641936, 0.00865701 ], [ 0.00095221, 0.00641936, -0.00865701 ], [ -0.00095221, 0.00641936, -0.00865701 ], [ -0.00095221, -0.00641936, 0.00865701 ], [ -0.00246945, -0.00252389, 0.00515652 ], [ -0.00246945, 0.00252389, -0.00515652 ], [ 0.00246945, 0.00252389, -0.00515652 ], [ 0.00246945, -0.00252389, 0.00515652 ], [ 0.00976218, -0.0086607, -0.00421763 ], [ 0.00976218, 0.0086607, 0.00421763 ], [ -0.00976218, 0.0086607, 0.00421763 ], [ -0.00976218, -0.0086607, -0.00421763 ] ]
pbe
true
15
agm005266151-pbe-479
479
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.51302987, 7.17293278, -0.04355321 ], [ -3.51302987, 7.17293278, -0.04355321 ], [ 0, 3.93814154, 6.08050399 ] ]
agm005266151
[ [ 1.756514935, 3.58646639, -0.021776605 ], [ -1.756514935, 5.55553716, 3.0184753900000003 ], [ 0.79336239565845, 3.7475346746090104, 2.6751871932790015 ], [ 0.7933623956584501, 12.56740165539099, 0.2779583817209988 ], [ -0.7933623956584501, 14.53647242539099, 3.318210376720999 ], [ -0.79336239565845, 5.71660544460901, 5.715439188279002 ], [ -2.699849805369204, 10.359927171870659, 3.955048421332223 ], [ -2.699849805369205, 9.893150698129341, 5.078601143667777 ], [ 2.699849805369205, 7.924079928129341, 2.038349148667777 ], [ 2.699849805369204, 8.390856401870659, 0.9147964263322235 ], [ -2.0022363737689552, 10.269087634507352, 1.78126331846807 ], [ -2.002236373768955, 6.045848695492649, 1.1718822565319302 ], [ 2.002236373768955, 8.014919465492648, 4.212134251531929 ], [ 2.0022363737689552, 12.238158404507352, 4.821515313468071 ], [ 0.12614267971477833, 4.7852713424409465, 2.418550001627025 ], [ 0.12614267971477844, 11.529664987559052, 0.5345955733729753 ], [ -0.12614267971477844, 13.498735757559052, 3.5748475683729755 ], [ -0.12614267971477833, 6.754342112440947, 5.458801996627026 ], [ -1.0573191293554063, 13.114209711611608, 5.803727724221553 ], [ -1.0573191293554063, 7.138868158388393, 3.2299218407784482 ], [ 1.0573191293554063, 5.1697973883883925, 0.18966984577844773 ], [ 1.0573191293554063, 11.145138941611608, 2.763475729221552 ] ]
[{"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 ]
[ [ 1.92524764, 0, 0 ], [ 0, 1.97457235, 0.35561482 ], [ 0, 0.35561481, 2.28288599 ] ]
-146.831413
-158.351413
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00727093, -0.0055106, -0.03180024 ], [ 0.00727093, 0.0055106, 0.03180024 ], [ -0.00727093, 0.0055106, 0.03180024 ], [ -0.00727093, -0.0055106, -0.03180024 ], [ 0.02303785, -0.01171184, 0.08116258 ], [ 0.02303785, 0.01171184, -0.08116258 ], [ -0.02303785, 0.01171184, -0.08116258 ], [ -0.02303785, -0.01171184, 0.08116258 ], [ 0.047718, -0.03942721, 0.04641728 ], [ 0.047718, 0.03942721, -0.04641728 ], [ -0.047718, 0.03942721, -0.04641728 ], [ -0.047718, -0.03942721, 0.04641728 ], [ 0.01999045, 0.0049249, 0.05458699 ], [ 0.01999045, -0.0049249, -0.05458699 ], [ -0.01999045, -0.0049249, -0.05458699 ], [ -0.01999045, 0.0049249, 0.05458699 ], [ 0.01930079, -0.00182608, 0.00479482 ], [ 0.01930079, 0.00182608, -0.00479482 ], [ -0.01930079, 0.00182608, -0.00479482 ], [ -0.01930079, -0.00182608, 0.00479482 ] ]
pbe
true
15
agm005266151-pbe-48
48
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26600949, 7.9450848, 0.08458363 ], [ -3.26600949, 7.9450848, 0.08458363 ], [ 0, 4.46078304, 6.19404145 ] ]
agm005266151
[ [ 1.633004745, 3.9725424, 0.042291815 ], [ -1.633004745, 6.2029339199999995, 3.13931254 ], [ 0.765269494093312, 4.154283313805981, 2.766003184535956 ], [ 0.765269494093312, 13.96627780619402, 0.5001848004640442 ], [ -0.765269494093312, 16.19666932619402, 3.5972055254640445 ], [ -0.765269494093312, 6.384674833805981, 5.863023909535956 ], [ -2.48749900555252, 11.52837077170199, 4.170751224747393 ], [ -2.48749900555252, 11.052973388298009, 5.289478210252607 ], [ 2.48749900555252, 8.822581868298009, 2.192457485252607 ], [ 2.48749900555252, 9.29797925170199, 1.073730499747393 ], [ -1.8567295304341105, 11.405482703175341, 1.9728335073908083 ], [ -1.8567295304341105, 6.715078416824659, 1.2933544776091919 ], [ 1.8567295304341105, 8.94546993682466, 4.390375202609192 ], [ 1.8567295304341105, 13.63587422317534, 5.069854232390808 ], [ 0.17537478094415038, 5.244173701542259, 2.5406155002069375 ], [ 0.17537478094415038, 12.876387418457739, 0.7255724847930627 ], [ -0.17537478094415038, 15.10677893845774, 3.8225932097930624 ], [ -0.17537478094415038, 7.474565221542259, 5.637636225206938 ], [ -0.7782228796517907, 14.869700105513328, 6.140355873973726 ], [ -0.7782228796517906, 7.711644054486673, 3.3198735610262746 ], [ 0.7782228796517906, 5.481252534486672, 0.22285283602627481 ], [ 0.7782228796517907, 12.639308585513326, 3.0433351489737253 ] ]
[{"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 ]
[ [ 0.24131941, 0, 0 ], [ 0, 0.42977377, -0.07540488 ], [ 0, -0.0754049, -0.12577033 ] ]
-146.984218
-158.504218
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.0025789, 0.00358956, -0.01410953 ], [ -0.0025789, -0.00358956, 0.01410953 ], [ 0.0025789, -0.00358956, 0.01410953 ], [ 0.0025789, 0.00358956, -0.01410953 ], [ 0.00102898, 0.01582357, -0.0346824 ], [ 0.00102898, -0.01582357, 0.0346824 ], [ -0.00102898, -0.01582357, 0.0346824 ], [ -0.00102898, 0.01582357, -0.0346824 ], [ 0.00060309, -0.00741706, 0.00998647 ], [ 0.00060309, 0.00741706, -0.00998647 ], [ -0.00060309, 0.00741706, -0.00998647 ], [ -0.00060309, -0.00741706, 0.00998647 ], [ -0.00558758, 0.00200974, 0.00493574 ], [ -0.00558758, -0.00200974, -0.00493574 ], [ 0.00558758, -0.00200974, -0.00493574 ], [ 0.00558758, 0.00200974, 0.00493574 ], [ 0.00977259, -0.01019767, -0.0038045 ], [ 0.00977259, 0.01019767, 0.0038045 ], [ -0.00977259, 0.01019767, 0.0038045 ], [ -0.00977259, -0.01019767, -0.0038045 ] ]
pbe
true
15
agm005266151-pbe-480
480
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26658501, 7.94464179, 0.08476654 ], [ -3.26658501, 7.94464179, 0.08476654 ], [ 0, 4.46067815, 6.19392456 ] ]
agm005266151
[ [ 1.633292505, 3.972320895, 0.04238327 ], [ -1.633292505, 6.20265997, 3.1393455500000003 ], [ 0.7652408861755828, 4.1539726109691415, 2.7658416741240375 ], [ 0.7652408861755831, 13.96565004403086, 0.5006536858759626 ], [ -0.7652408861755831, 16.19598911903086, 3.597615965875963 ], [ -0.7652408861755828, 6.384311685969141, 5.862803954124037 ], [ -2.487970463466677, 11.527801674450211, 4.170762261269171 ], [ -2.4879704634666764, 11.052499130549789, 5.289657658730829 ], [ 2.4879704634666764, 8.822160055549789, 2.1926953787308294 ], [ 2.487970463466677, 9.297462599450212, 1.0737999812691705 ], [ -1.8570462937004275, 11.404764800017519, 1.973023809663662 ], [ -1.8570462937004277, 6.7148578549824816, 1.2934715503363383 ], [ 1.8570462937004277, 8.945196929982481, 4.390433830336338 ], [ 1.8570462937004275, 13.635103875017519, 5.0699860896636615 ], [ 0.1750564866810006, 5.243566734961654, 2.5403462484300623 ], [ 0.17505648668100093, 12.876055920038347, 0.726149111569938 ], [ -0.17505648668100093, 15.106394995038347, 3.823111391569938 ], [ -0.1750564866810006, 7.4739058099616535, 5.6373085284300615 ], [ -0.7781124397514367, 14.869097203917782, 6.1404707842684605 ], [ -0.7781124397514365, 7.71120360108222, 3.319949135731539 ], [ 0.7781124397514365, 5.48086452608222, 0.2229868557315396 ], [ 0.7781124397514367, 12.638758128917782, 3.043508504268461 ] ]
[{"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 ]
[ [ 0.25459449, 0, 0 ], [ 0, 0.52042414, -0.08280675 ], [ 0, -0.08280677, -0.10304504 ] ]
-146.984251
-158.504251
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00043941, 0.00092682, -0.01375079 ], [ -0.00043941, -0.00092682, 0.01375079 ], [ 0.00043941, -0.00092682, 0.01375079 ], [ 0.00043941, 0.00092682, -0.01375079 ], [ 0.00101907, 0.01025737, -0.02167059 ], [ 0.00101907, -0.01025737, 0.02167059 ], [ -0.00101907, -0.01025737, 0.02167059 ], [ -0.00101907, 0.01025737, -0.02167059 ], [ 0.00124426, -0.00744224, 0.00775304 ], [ 0.00124426, 0.00744224, -0.00775304 ], [ -0.00124426, 0.00744224, -0.00775304 ], [ -0.00124426, -0.00744224, 0.00775304 ], [ -0.00834204, 0.00672183, 0.00380711 ], [ -0.00834204, -0.00672183, -0.00380711 ], [ 0.00834204, -0.00672183, -0.00380711 ], [ 0.00834204, 0.00672183, 0.00380711 ], [ 0.00879196, -0.00926956, -0.00334344 ], [ 0.00879196, 0.00926956, 0.00334344 ], [ -0.00879196, 0.00926956, 0.00334344 ], [ -0.00879196, -0.00926956, -0.00334344 ] ]
pbe
true
15
agm005266151-pbe-481
481
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26831158, 7.94331275, 0.08531526 ], [ -3.26831158, 7.94331275, 0.08531526 ], [ 0, 4.46036348, 6.19357391 ] ]
agm005266151
[ [ 1.63415579, 3.971656375, 0.04265763 ], [ -1.63415579, 6.201838114999999, 3.1394445849999997 ], [ 0.765154719175277, 4.153040665021427, 2.7653571172354803 ], [ 0.765154719175277, 13.963766574978571, 0.5020603577645193 ], [ -0.765154719175277, 16.19394831497857, 3.5988473127645193 ], [ -0.765154719175277, 6.383222405021427, 5.8621440722354805 ], [ -2.4893848821720352, 11.526094345411039, 4.170795291324069 ], [ -2.489384882172035, 11.051076374588959, 5.290196093675931 ], [ 2.489384882172035, 8.82089463458896, 2.193409138675931 ], [ 2.4893848821720352, 9.295912605411038, 1.0740083363240687 ], [ -1.8579966652027036, 11.402611011266204, 1.9735947986007467 ], [ -1.8579966652027036, 6.714196228733794, 1.2938226763992533 ], [ 1.8579966652027036, 8.944377968733793, 4.390609631399253 ], [ 1.8579966652027036, 13.632792751266205, 5.0703817536007465 ], [ 0.17410116029523104, 5.241745961976614, 2.539538582395249 ], [ 0.17410116029523115, 12.875061278023386, 0.7278788926047507 ], [ -0.17410116029523115, 15.105243018023387, 3.8246658476047504 ], [ -0.17410116029523104, 7.471927701976614, 5.6363255373952486 ], [ -0.7777807297386699, 14.867288220601575, 6.140815487817801 ], [ -0.77778072973867, 7.709882499398425, 3.3201758971821977 ], [ 0.77778072973867, 5.479700759398424, 0.22338894218219796 ], [ 0.7777807297386699, 12.637106480601574, 3.044028532817802 ] ]
[{"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 ]
[ [ 0.25649188, 0, 0 ], [ 0, 0.74228858, -0.10178562 ], [ 0, -0.1017856, -0.08557784 ] ]
-146.984304
-158.504304
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00581721, -0.007598, -0.01218256 ], [ 0.00581721, 0.007598, 0.01218256 ], [ -0.00581721, 0.007598, 0.01218256 ], [ -0.00581721, -0.007598, -0.01218256 ], [ 0.0006101, -0.0067883, 0.0177451 ], [ 0.0006101, 0.0067883, -0.0177451 ], [ -0.0006101, 0.0067883, -0.0177451 ], [ -0.0006101, -0.0067883, 0.0177451 ], [ 0.00264781, -0.00827499, 0.00231937 ], [ 0.00264781, 0.00827499, -0.00231937 ], [ -0.00264781, 0.00827499, -0.00231937 ], [ -0.00264781, -0.00827499, 0.00231937 ], [ -0.01689194, 0.01951051, -0.0001485 ], [ -0.01689194, -0.01951051, 0.0001485 ], [ 0.01689194, -0.01951051, 0.0001485 ], [ 0.01689194, 0.01951051, -0.0001485 ], [ 0.0067341, -0.0073969, -0.00209861 ], [ 0.0067341, 0.0073969, 0.00209861 ], [ -0.0067341, 0.0073969, 0.00209861 ], [ -0.0067341, -0.0073969, -0.00209861 ] ]
pbe
true
15
agm005266151-pbe-482
482
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26909788, 7.94307242, 0.08550454 ], [ -3.26909788, 7.94307242, 0.08550454 ], [ 0, 4.46037832, 6.19336894 ] ]
agm005266151
[ [ 1.63454894, 3.97153621, 0.04275227 ], [ -1.63454894, 6.20172537, 3.13943674 ], [ 0.765164722883012, 4.152751226553896, 2.7650378520903973 ], [ 0.7651647228830121, 13.963582773446104, 0.5026556979096026 ], [ -0.7651647228830121, 16.193771933446104, 3.599340167909603 ], [ -0.765164722883012, 6.382940386553896, 5.861722322090397 ], [ -2.4900225245089906, 11.52577535273996, 4.1708333264956154 ], [ -2.490022524508991, 11.050936967260041, 5.290229163504384 ], [ 2.490022524508991, 8.820747807260041, 2.193544693504384 ], [ 2.4900225245089906, 9.29558619273996, 1.074148856495616 ], [ -1.858413984089202, 11.402099353266046, 1.9737792036937238 ], [ -1.8584139840892018, 6.714234646733954, 1.293914346306276 ], [ 1.8584139840892018, 8.944423806733955, 4.390598816306277 ], [ 1.858413984089202, 13.632288513266046, 5.070463673693723 ], [ 0.1735905358310672, 5.241289471624422, 2.539150023122018 ], [ 0.17359053583106743, 12.875044528375577, 0.7285435268779822 ], [ -0.17359053583106743, 15.105233688375577, 3.8252279968779823 ], [ -0.1735905358310672, 7.471478631624422, 5.635834493122018 ], [ -0.7776083805083382, 14.867049214979673, 6.140836317557715 ], [ -0.7776083805083379, 7.709663105020328, 3.320226172442285 ], [ 0.7776083805083379, 5.479473945020328, 0.2235417024422846 ], [ 0.7776083805083382, 12.636860054979673, 3.0441518475577154 ] ]
[{"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 ]
[ [ 0.12881809, 0, 0 ], [ 0, 0.47017427, -0.10962669 ], [ 0, -0.10962676, 0.02788661 ] ]
-146.984346
-158.504346
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00219243, -0.00339276, -0.00717231 ], [ 0.00219243, 0.00339276, 0.00717231 ], [ -0.00219243, 0.00339276, 0.00717231 ], [ -0.00219243, -0.00339276, -0.00717231 ], [ 0.00011107, -0.00299313, 0.00943498 ], [ 0.00011107, 0.00299313, -0.00943498 ], [ -0.00011107, 0.00299313, -0.00943498 ], [ -0.00011107, -0.00299313, 0.00943498 ], [ 0.00212406, -0.00661628, -0.00015151 ], [ 0.00212406, 0.00661628, 0.00015151 ], [ -0.00212406, 0.00661628, 0.00015151 ], [ -0.00212406, -0.00661628, -0.00015151 ], [ -0.01268632, 0.01282314, -0.00010188 ], [ -0.01268632, -0.01282314, 0.00010188 ], [ 0.01268632, -0.01282314, 0.00010188 ], [ 0.01268632, 0.01282314, -0.00010188 ], [ 0.00447163, -0.004429, -0.00146013 ], [ 0.00447163, 0.004429, 0.00146013 ], [ -0.00447163, 0.004429, 0.00146013 ], [ -0.00447163, -0.004429, -0.00146013 ] ]
pbe
true
15
agm005266151-pbe-483
483
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.26974235, 7.94287545, 0.08565967 ], [ -3.26974235, 7.94287545, 0.08565967 ], [ 0, 4.46039048, 6.19320094 ] ]
agm005266151
[ [ 1.634871175, 3.971437725, 0.042829835 ], [ -1.634871175, 6.201632965, 3.139430305 ], [ 0.7651729086080346, 4.15251397329401, 2.764776194014531 ], [ 0.7651729086080348, 13.96343216670599, 0.5031436159854686 ], [ -0.7651729086080348, 16.19362740670599, 3.5997440859854684 ], [ -0.7651729086080346, 6.38270921329401, 5.861376664014531 ], [ -2.4905451894785804, 11.525514039263317, 4.17086450875005 ], [ -2.490545189478581, 11.050822580736682, 5.29025624124995 ], [ 2.490545189478581, 8.820627340736683, 2.1936557712499503 ], [ 2.4905451894785804, 9.295318799263317, 1.0742640387500497 ], [ -1.8587560249639183, 11.401679931064919, 1.9739303640335388 ], [ -1.8587560249639183, 6.714266208935078, 1.293989445966461 ], [ 1.8587560249639183, 8.94446144893508, 4.390589915966461 ], [ 1.8587560249639183, 13.63187517106492, 5.070530834033539 ], [ 0.17317196355100595, 5.240915321025902, 2.5388315853183467 ], [ 0.17317196355100606, 12.875030818974098, 0.7290882246816532 ], [ -0.17317196355100606, 15.105226058974099, 3.825688694681653 ], [ -0.17317196355100595, 7.471110561025902, 5.635432055318346 ], [ -0.7774671071466108, 14.866853309182797, 6.140853343021603 ], [ -0.777467107146611, 7.709483310817204, 3.3202674069783966 ], [ 0.777467107146611, 5.479288070817203, 0.2236669369783968 ], [ 0.7774671071466108, 12.636658069182797, 3.0442528730216027 ] ]
[{"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 ]
[ [ 0.0465823, 0, 0 ], [ 0, 0.26940727, -0.11945429 ], [ 0, -0.11945427, 0.14427828 ] ]
-146.984371
-158.504371
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00074906, 0.00054207, -0.00329634 ], [ -0.00074906, -0.00054207, 0.00329634 ], [ 0.00074906, -0.00054207, 0.00329634 ], [ 0.00074906, 0.00054207, -0.00329634 ], [ -0.00016677, 0.00033926, 0.00242946 ], [ -0.00016677, -0.00033926, -0.00242946 ], [ 0.00016677, -0.00033926, -0.00242946 ], [ 0.00016677, 0.00033926, 0.00242946 ], [ 0.00177891, -0.00463295, -0.00258706 ], [ 0.00177891, 0.00463295, 0.00258706 ], [ -0.00177891, 0.00463295, 0.00258706 ], [ -0.00177891, -0.00463295, -0.00258706 ], [ -0.00944767, 0.00747583, -0.0003423 ], [ -0.00944767, -0.00747583, 0.0003423 ], [ 0.00944767, -0.00747583, 0.0003423 ], [ 0.00944767, 0.00747583, -0.0003423 ], [ 0.0026962, -0.00141824, -0.00130247 ], [ 0.0026962, 0.00141824, 0.00130247 ], [ -0.0026962, 0.00141824, 0.00130247 ], [ -0.0026962, -0.00141824, -0.00130247 ] ]
pbe
true
15
agm005266151-pbe-484
484
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27103129, 7.94248149, 0.08596995 ], [ -3.27103129, 7.94248149, 0.08596995 ], [ 0, 4.4604148, 6.19286494 ] ]
agm005266151
[ [ 1.635515645, 3.971240745, 0.042984975 ], [ -1.635515645, 6.201448145, 3.139417445 ], [ 0.7651891113487228, 4.152039620897379, 2.764252919706168 ], [ 0.765189111348723, 13.963130759102622, 0.504119450293832 ], [ -0.765189111348723, 16.193338159102623, 3.6005519202938316 ], [ -0.7651891113487228, 6.3822470208973785, 5.860685389706167 ], [ -2.4915904915826244, 11.524991237183853, 4.170926892868405 ], [ -2.4915904915826244, 11.050593942816146, 5.290310417131595 ], [ 2.4915904915826244, 8.820386542816145, 2.1938779471315955 ], [ 2.4915904915826244, 9.294783837183852, 1.0744944228684044 ], [ -1.8594401106545233, 11.400840964008307, 1.9742326251096445 ], [ -1.8594401106545235, 6.714329415991692, 1.2941397448903555 ], [ 1.8594401106545235, 8.944536815991691, 4.390572214890355 ], [ 1.8594401106545233, 13.631048364008306, 5.070665095109645 ], [ 0.1723343816445887, 5.240167051993543, 2.5381947012313066 ], [ 0.17233438164458859, 12.875003328006455, 0.7301776687686931 ], [ -0.17233438164458859, 15.105210728006455, 3.826610138768693 ], [ -0.1723343816445887, 7.4703744519935436, 5.634627171231307 ], [ -0.7771842774819688, 14.866461618934547, 6.140887434800111 ], [ -0.7771842774819688, 7.709123561065453, 3.3203498751998892 ], [ 0.7771842774819688, 5.478916161065452, 0.22391740519988879 ], [ 0.7771842774819688, 12.636254218934546, 3.0444549648001114 ] ]
[{"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 ]
[ [ -0.14059356, 0, 0 ], [ 0, -0.18356914, -0.13135012 ], [ 0, -0.13135015, 0.32396553 ] ]
-146.98439
-158.50439
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00675654, 0.00782747, 0.00548549 ], [ -0.00675654, -0.00782747, -0.00548549 ], [ 0.00675654, -0.00782747, -0.00548549 ], [ 0.00675654, 0.00782747, 0.00548549 ], [ -0.00106361, 0.00675084, -0.01125272 ], [ -0.00106361, -0.00675084, 0.01125272 ], [ 0.00106361, -0.00675084, 0.01125272 ], [ 0.00106361, 0.00675084, -0.01125272 ], [ 0.00099581, -0.00194978, -0.00636346 ], [ 0.00099581, 0.00194978, 0.00636346 ], [ -0.00099581, 0.00194978, 0.00636346 ], [ -0.00099581, -0.00194978, -0.00636346 ], [ -0.00346691, -0.00435332, -0.00082222 ], [ -0.00346691, 0.00435332, 0.00082222 ], [ 0.00346691, 0.00435332, 0.00082222 ], [ 0.00346691, -0.00435332, -0.00082222 ], [ -0.00044681, 0.00347169, -0.0003636 ], [ -0.00044681, -0.00347169, 0.0003636 ], [ 0.00044681, -0.00347169, 0.0003636 ], [ 0.00044681, 0.00347169, -0.0003636 ] ]
pbe
true
15
agm005266151-pbe-485
485
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27168445, 7.94214805, 0.08605167 ], [ -3.27168445, 7.94214805, 0.08605167 ], [ 0, 4.46029193, 6.19280314 ] ]
agm005266151
[ [ 1.635842225, 3.971074025, 0.043025835 ], [ -1.635842225, 6.20121999, 3.1394274049999997 ], [ 0.765126856601996, 4.151763587241673, 2.7640519734613123 ], [ 0.765126856601996, 13.962678477758327, 0.5044529365386876 ], [ -0.765126856601996, 16.192824442758326, 3.600854506538687 ], [ -0.765126856601996, 6.381909552241673, 5.860453543461312 ], [ -2.4921318533031522, 11.52455141734928, 4.170843329393663 ], [ -2.4921318533031522, 11.050182577650721, 5.290464720606336 ], [ 2.4921318533031522, 8.820036612650721, 2.1940631506063366 ], [ 2.4921318533031522, 9.294405452349277, 1.074441759393663 ], [ -1.8597761678826115, 11.400177680478224, 1.9742647096420747 ], [ -1.8597761678826115, 6.714264384521777, 1.2942402003579252 ], [ 1.8597761678826115, 8.944410349521778, 4.390641770357925 ], [ 1.8597761678826115, 13.630323645478224, 5.070666279642074 ], [ 0.171851507370394, 5.239618191886862, 2.5378569441733507 ], [ 0.1718515073703939, 12.87482387311314, 0.7306479658266489 ], [ -0.1718515073703939, 15.10496983811314, 3.827049535826649 ], [ -0.171851507370394, 7.469764156886862, 5.634258514173351 ], [ -0.777027805089938, 14.865989211936114, 6.14090539983369 ], [ -0.777027805089938, 7.708744783063887, 3.3204026501663093 ], [ 0.777027805089938, 5.478598818063887, 0.2240010801663096 ], [ 0.777027805089938, 12.635843246936114, 3.0445038298336904 ] ]
[{"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 ]
[ [ -0.2300173, 0, 0 ], [ 0, -0.33665681, -0.1119571 ], [ 0, -0.11195715, 0.12461327 ] ]
-146.984399
-158.504399
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00471313, 0.00542069, 0.00360161 ], [ -0.00471313, -0.00542069, -0.00360161 ], [ 0.00471313, -0.00542069, -0.00360161 ], [ 0.00471313, 0.00542069, 0.00360161 ], [ -0.00115561, -0.00118721, 0.00748818 ], [ -0.00115561, 0.00118721, -0.00748818 ], [ 0.00115561, 0.00118721, -0.00748818 ], [ 0.00115561, -0.00118721, 0.00748818 ], [ -0.00185996, 0.00206857, -0.00467734 ], [ -0.00185996, -0.00206857, 0.00467734 ], [ 0.00185996, -0.00206857, 0.00467734 ], [ 0.00185996, 0.00206857, -0.00467734 ], [ -0.00200507, -0.0051898, -0.00133305 ], [ -0.00200507, 0.0051898, 0.00133305 ], [ 0.00200507, 0.0051898, 0.00133305 ], [ 0.00200507, -0.0051898, -0.00133305 ], [ -0.00189889, 0.00509738, 0.00011184 ], [ -0.00189889, -0.00509738, -0.00011184 ], [ 0.00189889, -0.00509738, -0.00011184 ], [ 0.00189889, 0.00509738, 0.00011184 ] ]
pbe
true
15
agm005266151-pbe-486
486
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27166413, 7.94215842, 0.08604913 ], [ -3.27166413, 7.94215842, 0.08604913 ], [ 0, 4.46029575, 6.19280506 ] ]
agm005266151
[ [ 1.635832065, 3.97107921, 0.043024565 ], [ -1.635832065, 6.201227085, 3.1394270950000003 ], [ 0.7651288114116128, 4.151772140039334, 2.7640582531316182 ], [ 0.7651288114116128, 13.962692574960665, 0.5044425368683816 ], [ -0.7651288114116128, 16.192840449960666, 3.6008450668683816 ], [ -0.7651288114116128, 6.381920015039334, 5.86046078313162 ], [ -2.492115000902434, 11.524565071211345, 4.170845901803178 ], [ -2.492115000902434, 11.050195393788655, 5.2904599481968235 ], [ 2.492115000902434, 8.820047518788655, 2.1940574181968233 ], [ 2.492115000902434, 9.294417196211345, 1.0744433718031772 ], [ -1.8597657294242733, 11.400198318954157, 1.9742636766831703 ], [ -1.8597657294242733, 6.7142663960458435, 1.29423711331683 ], [ 1.8597657294242733, 8.944414271045844, 4.39063964331683 ], [ 1.8597657294242733, 13.630346193954157, 5.07066620668317 ], [ 0.17186656932754052, 5.2396352859132715, 2.5378674924366895 ], [ 0.1718665693275403, 12.874829429086729, 0.7306332975633107 ], [ -0.1718665693275403, 15.104977304086729, 3.827035827563311 ], [ -0.17186656932754052, 7.469783160913272, 5.63427002243669 ], [ -0.7770326631986944, 14.866003891361554, 6.1409048552780146 ], [ -0.777032663198694, 7.708756573638449, 3.3204009947219864 ], [ 0.777032663198694, 5.478608698638449, 0.223998464721986 ], [ 0.7770326631986944, 12.635856016361553, 3.0445023252780143 ] ]
[{"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 ]
[ [ -0.22274591, 0, 0 ], [ 0, -0.33154355, -0.11027515 ], [ 0, -0.11027522, 0.13021023 ] ]
-146.984399
-158.504399
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00462426, 0.00556949, 0.00418129 ], [ -0.00462426, -0.00556949, -0.00418129 ], [ 0.00462426, -0.00556949, -0.00418129 ], [ 0.00462426, 0.00556949, 0.00418129 ], [ -0.00119488, -0.00100251, 0.00715343 ], [ -0.00119488, 0.00100251, -0.00715343 ], [ 0.00119488, 0.00100251, -0.00715343 ], [ 0.00119488, -0.00100251, 0.00715343 ], [ -0.00174382, 0.00196385, -0.00467876 ], [ -0.00174382, -0.00196385, 0.00467876 ], [ 0.00174382, -0.00196385, 0.00467876 ], [ 0.00174382, 0.00196385, -0.00467876 ], [ -0.00167327, -0.00493372, -0.0007649 ], [ -0.00167327, 0.00493372, 0.0007649 ], [ 0.00167327, 0.00493372, 0.0007649 ], [ 0.00167327, -0.00493372, -0.0007649 ], [ -0.00234187, 0.00496649, 0.00030461 ], [ -0.00234187, -0.00496649, -0.00030461 ], [ 0.00234187, -0.00496649, -0.00030461 ], [ 0.00234187, 0.00496649, 0.00030461 ] ]
pbe
true
15
agm005266151-pbe-487
487
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27155754, 7.94221283, 0.08603579 ], [ -3.27155754, 7.94221283, 0.08603579 ], [ 0, 4.4603158, 6.19281514 ] ]
agm005266151
[ [ 1.63577877, 3.971106415, 0.043017895 ], [ -1.63577877, 6.2012643149999995, 3.1394254650000004 ], [ 0.7651389548029169, 4.151817201491191, 2.7640909915220617 ], [ 0.765138954802917, 13.962766358508807, 0.5043881584779384 ], [ -0.765138954802917, 16.192924258508807, 3.6007957284779386 ], [ -0.7651389548029169, 6.381975101491191, 5.860498561522062 ], [ -2.492026676422869, 11.52463678730403, 4.170859556010264 ], [ -2.492026676422869, 11.05026257269597, 5.290434733989737 ], [ 2.492026676422869, 8.820104672695972, 2.1940271639897375 ], [ 2.492026676422869, 9.29447888730403, 1.0744519860102633 ], [ -1.8597108966627014, 11.400306597256064, 1.9742584773580845 ], [ -1.8597108966627016, 6.714276962743934, 1.2942206726419156 ], [ 1.8597108966627016, 8.944434862743934, 4.390628242641916 ], [ 1.8597108966627014, 13.630464497256064, 5.070666047358085 ], [ 0.1719453434266056, 5.239724782100124, 2.5379225743566995 ], [ 0.1719453434266054, 12.874858777899876, 0.7305565756433008 ], [ -0.1719453434266054, 15.105016677899876, 3.8269641456433012 ], [ -0.1719453434266056, 7.469882682100123, 5.634330144356699 ], [ -0.7770582203883984, 14.866081024520469, 6.140901929573869 ], [ -0.777058220388399, 7.708818335479531, 3.320392360426132 ], [ 0.777058220388399, 5.478660435479532, 0.22398479042613173 ], [ 0.7770582203883984, 12.635923124520469, 3.0444943595738683 ] ]
[{"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 ]
[ [ -0.17364234, 0, 0 ], [ 0, -0.27405669, -0.11258653 ], [ 0, -0.11258662, 0.19501091 ] ]
-146.984398
-158.504398
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00532857, 0.00580168, 0.00418375 ], [ -0.00532857, -0.00580168, -0.00418375 ], [ 0.00532857, -0.00580168, -0.00418375 ], [ 0.00532857, 0.00580168, 0.00418375 ], [ -0.0014681, 0.00022522, 0.00398587 ], [ -0.0014681, -0.00022522, -0.00398587 ], [ 0.0014681, -0.00022522, -0.00398587 ], [ 0.0014681, 0.00022522, 0.00398587 ], [ -0.00150652, 0.00109297, -0.00526494 ], [ -0.00150652, -0.00109297, 0.00526494 ], [ 0.00150652, -0.00109297, 0.00526494 ], [ 0.00150652, 0.00109297, -0.00526494 ], [ -0.00253753, -0.00515709, -0.00079205 ], [ -0.00253753, 0.00515709, 0.00079205 ], [ 0.00253753, 0.00515709, 0.00079205 ], [ 0.00253753, -0.00515709, -0.00079205 ], [ -0.00212715, 0.00511179, 0.00028922 ], [ -0.00212715, -0.00511179, -0.00028922 ], [ 0.00212715, -0.00511179, -0.00028922 ], [ 0.00212715, 0.00511179, 0.00028922 ] ]
pbe
true
15
agm005266151-pbe-488
488
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27161268, 7.94218468, 0.08604269 ], [ -3.27161268, 7.94218468, 0.08604269 ], [ 0, 4.46030543, 6.19280993 ] ]
agm005266151
[ [ 1.63580634, 3.97109234, 0.043021345 ], [ -1.63580634, 6.201245055, 3.13942631 ], [ 0.76513369327794, 4.151793857495139, 2.7640740528039345 ], [ 0.7651336932779405, 13.962728217504862, 0.5044162921960658 ], [ -0.7651336932779405, 16.192880932504863, 3.6008212571960656 ], [ -0.76513369327794, 6.381946572495139, 5.860479017803934 ], [ -2.4920723748534264, 11.52459967324781, 4.170852527617646 ], [ -2.4920723748534264, 11.050227831752192, 5.290447747382355 ], [ 2.4920723748534264, 8.820075116752191, 2.194042782382355 ], [ 2.4920723748534264, 9.29444695824781, 1.0744475626176453 ], [ -1.8597392310111298, 11.400250569491769, 1.9742611570781303 ], [ -1.8597392310111303, 6.714271505508233, 1.29422918792187 ], [ 1.8597392310111303, 8.944424220508232, 4.39063415292187 ], [ 1.8597392310111298, 13.63040328449177, 5.070666122078131 ], [ 0.17190456542559718, 5.239678493852451, 2.5378940704540778 ], [ 0.17190456542559707, 12.87484358114755, 0.7305962745459222 ], [ -0.17190456542559707, 15.10499629614755, 3.8270012395459228 ], [ -0.17190456542559718, 7.469831208852451, 5.634299035454078 ], [ -0.7770449807232838, 14.866041160360432, 6.140903442754683 ], [ -0.777044980723284, 7.708786344639569, 3.320396832245317 ], [ 0.777044980723284, 5.478633629639569, 0.223991867245317 ], [ 0.7770449807232838, 12.635888445360433, 3.044498477754683 ] ]
[{"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 ]
[ [ -0.2057584, 0, 0 ], [ 0, -0.32321561, -0.11290816 ], [ 0, -0.11290821, 0.14957642 ] ]
-146.984399
-158.504399
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00487675, 0.00583783, 0.00430204 ], [ -0.00487675, -0.00583783, -0.00430204 ], [ 0.00487675, -0.00583783, -0.00430204 ], [ 0.00487675, 0.00583783, 0.00430204 ], [ -0.00120443, -0.00032989, 0.00554865 ], [ -0.00120443, 0.00032989, -0.00554865 ], [ 0.00120443, 0.00032989, -0.00554865 ], [ 0.00120443, -0.00032989, 0.00554865 ], [ -0.00149387, 0.00132475, -0.00479617 ], [ -0.00149387, -0.00132475, 0.00479617 ], [ 0.00149387, -0.00132475, 0.00479617 ], [ 0.00149387, 0.00132475, -0.00479617 ], [ -0.00267732, -0.0056226, -0.00133111 ], [ -0.00267732, 0.0056226, 0.00133111 ], [ 0.00267732, 0.0056226, 0.00133111 ], [ 0.00267732, -0.0056226, -0.00133111 ], [ -0.00134439, 0.00504597, 0.00019273 ], [ -0.00134439, -0.00504597, -0.00019273 ], [ 0.00134439, -0.00504597, -0.00019273 ], [ 0.00134439, 0.00504597, 0.00019273 ] ]
pbe
true
15
agm005266151-pbe-489
489
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.50854704, 7.17992627, -0.04847468 ], [ -3.50854704, 7.17992627, -0.04847468 ], [ 0, 3.93781228, 6.08100794 ] ]
agm005266151
[ [ 1.75427352, 3.589963135, -0.02423734 ], [ -1.75427352, 5.558869275, 3.01626663 ], [ 0.7950460919991262, 3.7490628956853014, 2.6731568828877172 ], [ 0.7950460919991262, 12.5796957843147, 0.270397727112283 ], [ -0.7950460919991262, 14.5486019243147, 3.3109016971122833 ], [ -0.7950460919991262, 5.717969035685301, 5.713660852887717 ], [ -2.695951230792264, 10.366740128094712, 3.949594990110211 ], [ -2.695951230792264, 9.89983083190529, 5.07496755988979 ], [ 2.695951230792264, 7.93092469190529, 2.0344635898897896 ], [ 2.695951230792264, 8.39783398809471, 0.9090910201102104 ], [ -1.9972795228194957, 10.276997777278059, 1.7744125011312843 ], [ -1.9972795228194962, 6.051760902721943, 1.1691421088687157 ], [ 1.9972795228194962, 8.020667042721943, 4.209646078868715 ], [ 1.9972795228194957, 12.245903917278058, 4.814916471131285 ], [ 0.12886623119797924, 4.78908412031756, 2.421956110092387 ], [ 0.1288662311979789, 11.53967455968244, 0.5215984999076131 ], [ -0.1288662311979789, 13.508580699682442, 3.562102469907613 ], [ -0.12886623119797924, 6.75799026031756, 5.462460080092386 ], [ -1.0511191169015763, 13.125387093929982, 5.795072994651803 ], [ -1.051119116901576, 7.141183866070019, 3.2294895553481977 ], [ 1.051119116901576, 5.1722777260700195, 0.18898558534819782 ], [ 1.0511191169015763, 11.156480953929982, 2.7545690246518024 ] ]
[{"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 ]
[ [ 1.29716323, 0, 0 ], [ 0, 0.28362266, 1.44942096 ], [ 0, 1.44942091, -0.91929988 ] ]
-146.832654
-158.352654
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.01436088, -0.02588396, 0.06400532 ], [ -0.01436088, 0.02588396, -0.06400532 ], [ 0.01436088, 0.02588396, -0.06400532 ], [ 0.01436088, -0.02588396, 0.06400532 ], [ 0.03276459, -0.06080837, 0.17733194 ], [ 0.03276459, 0.06080837, -0.17733194 ], [ -0.03276459, 0.06080837, -0.17733194 ], [ -0.03276459, -0.06080837, 0.17733194 ], [ 0.03932225, -0.01780198, 0.03378022 ], [ 0.03932225, 0.01780198, -0.03378022 ], [ -0.03932225, 0.01780198, -0.03378022 ], [ -0.03932225, -0.01780198, 0.03378022 ], [ 0.04039393, -0.01305016, 0.02174338 ], [ 0.04039393, 0.01305016, -0.02174338 ], [ -0.04039393, 0.01305016, -0.02174338 ], [ -0.04039393, -0.01305016, 0.02174338 ], [ 0.00623529, 0.01142862, 0.00457854 ], [ 0.00623529, -0.01142862, -0.00457854 ], [ -0.00623529, -0.01142862, -0.00457854 ], [ -0.00623529, 0.01142862, 0.00457854 ] ]
pbe
true
15
agm005266151-pbe-49
49
0
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27164035, 7.94217056, 0.08604615 ], [ -3.27164035, 7.94217056, 0.08604615 ], [ 0, 4.46030023, 6.19280731 ] ]
agm005266151
[ [ 1.635820175, 3.97108528, 0.043023075 ], [ -1.635820175, 6.201235394999999, 3.13942673 ], [ 0.7651310693145019, 4.151782183946642, 2.76406554902651 ], [ 0.7651310693145019, 13.962709051053357, 0.5044304059734899 ], [ -0.7651310693145019, 16.192859166053356, 3.6008340609734897 ], [ -0.7651310693145019, 6.3819322989466425, 5.8604692040265105 ], [ -2.4920953166462922, 11.524581132207498, 4.170848953731831 ], [ -2.4920953166462922, 11.050210332792503, 5.290454311268169 ], [ 2.4920953166462922, 8.820060217792502, 2.194050656268169 ], [ 2.4920953166462922, 9.294431017207499, 1.0744452987318311 ], [ -1.8597534877083803, 11.400222494153411, 1.9742625050760745 ], [ -1.8597534877083801, 6.714268740846588, 1.2942334499239254 ], [ 1.8597534877083801, 8.944418855846589, 4.3906371049239254 ], [ 1.8597534877083803, 13.630372609153412, 5.070666160076074 ], [ 0.17188409933575644, 5.23965526223655, 2.537879785393867 ], [ 0.17188409933575644, 12.87483597276345, 0.730616169606133 ], [ -0.17188409933575644, 15.104986087763448, 3.8270198246061327 ], [ -0.17188409933575644, 7.4698053772365505, 5.634283440393867 ], [ -0.777038367950345, 14.866021092012675, 6.140904166612921 ], [ -0.7770383679503446, 7.708770372987324, 3.320399098387079 ], [ 0.7770383679503446, 5.478620257987325, 0.2239954433870795 ], [ 0.777038367950345, 12.635870977012676, 3.0445005116129202 ] ]
[{"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 ]
[ [ -0.20754861, 0, 0 ], [ 0, -0.32442205, -0.11262989 ], [ 0, -0.1126299, 0.14301881 ] ]
-146.984399
-158.504399
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00476142, 0.00577515, 0.0041899 ], [ -0.00476142, -0.00577515, -0.0041899 ], [ 0.00476142, -0.00577515, -0.0041899 ], [ 0.00476142, 0.00577515, 0.0041899 ], [ -0.00116231, -0.00061264, 0.00632939 ], [ -0.00116231, 0.00061264, -0.00632939 ], [ 0.00116231, 0.00061264, -0.00632939 ], [ 0.00116231, -0.00061264, 0.00632939 ], [ -0.00151412, 0.00162555, -0.00508304 ], [ -0.00151412, -0.00162555, 0.00508304 ], [ 0.00151412, -0.00162555, 0.00508304 ], [ 0.00151412, 0.00162555, -0.00508304 ], [ -0.00272069, -0.00541459, -0.00130142 ], [ -0.00272069, 0.00541459, 0.00130142 ], [ 0.00272069, 0.00541459, 0.00130142 ], [ 0.00272069, -0.00541459, -0.00130142 ], [ -0.00164699, 0.00544034, 0.00021977 ], [ -0.00164699, -0.00544034, -0.00021977 ], [ 0.00164699, -0.00544034, -0.00021977 ], [ 0.00164699, 0.00544034, 0.00021977 ] ]
pbe
true
15
agm005266151-pbe-490
490
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27165109, 7.94216508, 0.0860475 ], [ -3.27165109, 7.94216508, 0.0860475 ], [ 0, 4.46029821, 6.19280629 ] ]
agm005266151
[ [ 1.635825545, 3.97108254, 0.04302375 ], [ -1.635825545, 6.201231645, 3.139426895 ], [ 0.7651300476706375, 4.1517776267490465, 2.764062249325147 ], [ 0.7651300476706377, 13.962701638250953, 0.5044358956748529 ], [ -0.7651300476706377, 16.192850743250954, 3.600839040674853 ], [ -0.7651300476706375, 6.381926731749047, 5.860465394325146 ], [ -2.4921042173526793, 11.524573904088921, 4.1708475915208965 ], [ -2.4921042173526797, 11.050203570911078, 5.290456843479104 ], [ 2.4921042173526797, 8.820054465911078, 2.194053698479104 ], [ 2.4921042173526793, 9.29442479908892, 1.074444446520896 ], [ -1.8597590039298162, 11.400211666505637, 1.9742630729601967 ], [ -1.8597590039298155, 6.714267598494363, 1.2942350720398035 ], [ 1.8597590039298155, 8.944416703494364, 4.390638217039803 ], [ 1.8597590039298162, 13.630360771505636, 5.070666217960197 ], [ 0.17187619001315002, 5.239646258041364, 2.5378741806331067 ], [ 0.1718761900131498, 12.874833006958637, 0.7306239643668933 ], [ -0.1718761900131498, 15.104982111958638, 3.827027109366893 ], [ -0.17187619001315002, 7.4697953630413645, 5.634277325633107 ], [ -0.7770357822862133, 14.866013333730582, 6.140904487375633 ], [ -0.7770357822862131, 7.708764141269417, 3.320399947624366 ], [ 0.7770357822862131, 5.478615036269417, 0.22399680262436622 ], [ 0.7770357822862133, 12.635864228730581, 3.044501342375634 ] ]
[{"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 ]
[ [ -0.22869519, 0, 0 ], [ 0, -0.33967955, -0.10996324 ], [ 0, -0.1099632, 0.12369636 ] ]
-146.984399
-158.504399
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00478289, 0.00550263, 0.0042203 ], [ -0.00478289, -0.00550263, -0.0042203 ], [ 0.00478289, -0.00550263, -0.0042203 ], [ 0.00478289, 0.00550263, 0.0042203 ], [ -0.00129225, -0.00093146, 0.00680941 ], [ -0.00129225, 0.00093146, -0.00680941 ], [ 0.00129225, 0.00093146, -0.00680941 ], [ 0.00129225, -0.00093146, 0.00680941 ], [ -0.00184178, 0.00179189, -0.00464463 ], [ -0.00184178, -0.00179189, 0.00464463 ], [ 0.00184178, -0.00179189, 0.00464463 ], [ 0.00184178, 0.00179189, -0.00464463 ], [ -0.00200497, -0.00518371, -0.00096268 ], [ -0.00200497, 0.00518371, 0.00096268 ], [ 0.00200497, 0.00518371, 0.00096268 ], [ 0.00200497, -0.00518371, -0.00096268 ], [ -0.00220135, 0.00490457, 0.00026883 ], [ -0.00220135, -0.00490457, -0.00026883 ], [ 0.00220135, -0.00490457, -0.00026883 ], [ 0.00220135, 0.00490457, 0.00026883 ] ]
pbe
true
15
agm005266151-pbe-491
491
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27177425, 7.94184763, 0.08599952 ], [ -3.27177425, 7.94184763, 0.08599952 ], [ 0, 4.46008246, 6.19281152 ] ]
agm005266151
[ [ 1.635887125, 3.970923815, 0.04299976 ], [ -1.635887125, 6.200965045, 3.13940552 ], [ 0.7650544810874449, 4.151608340890942, 2.7640343448836258 ], [ 0.7650544810874456, 13.962128149109057, 0.5043704551163743 ], [ -0.7650544810874456, 16.192169379109057, 3.6007762151163742 ], [ -0.7650544810874449, 6.381649570890941, 5.860440104883626 ], [ -2.4922221773156377, 11.52408044601717, 4.170823953372229 ], [ -2.4922221773156377, 11.04973850398283, 5.2903923666277715 ], [ 2.4922221773156377, 8.819697273982829, 2.1939866066277713 ], [ 2.4922221773156377, 9.29403921601717, 1.0744181933722288 ], [ -1.8598358191059747, 11.399703182378902, 1.9741466686910338 ], [ -1.859835819105975, 6.714033307621097, 1.2942581313089665 ], [ 1.859835819105975, 8.944074537621097, 4.390663891308966 ], [ 1.8598358191059747, 13.629744412378901, 5.070552428691033 ], [ 0.17171805726123246, 5.23927410821499, 2.5377482968691756 ], [ 0.17171805726123246, 12.87446238178501, 0.730656503130824 ], [ -0.17171805726123246, 15.10450361178501, 3.827062263130824 ], [ -0.17171805726123246, 7.46931533821499, 5.634154056869177 ], [ -0.7769969151483398, 14.865452486057992, 6.140839866674352 ], [ -0.7769969151483399, 7.70836646394201, 3.320376453325648 ], [ 0.7769969151483399, 5.47832523394201, 0.223970693325648 ], [ 0.7769969151483398, 12.635411256057992, 3.044434106674352 ] ]
[{"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 ]
[ [ -0.1830355, 0, 0 ], [ 0, -0.1927631, -0.15757146 ], [ 0, -0.15757153, 0.08810411 ] ]
-146.984408
-158.504408
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00081213, -0.0011978, 0.00316486 ], [ -0.00081213, 0.0011978, -0.00316486 ], [ 0.00081213, 0.0011978, -0.00316486 ], [ 0.00081213, -0.0011978, 0.00316486 ], [ -0.00119047, 0.00131377, 0.00097551 ], [ -0.00119047, -0.00131377, -0.00097551 ], [ 0.00119047, -0.00131377, -0.00097551 ], [ 0.00119047, 0.00131377, 0.00097551 ], [ -0.00325012, 0.00288819, -0.00192414 ], [ -0.00325012, -0.00288819, 0.00192414 ], [ 0.00325012, -0.00288819, 0.00192414 ], [ 0.00325012, 0.00288819, -0.00192414 ], [ -0.0049337, -0.00112933, -0.0018521 ], [ -0.0049337, 0.00112933, 0.0018521 ], [ 0.0049337, 0.00112933, 0.0018521 ], [ 0.0049337, -0.00112933, -0.0018521 ], [ -0.00119684, 0.00377998, 0.00027006 ], [ -0.00119684, -0.00377998, -0.00027006 ], [ 0.00119684, -0.00377998, -0.00027006 ], [ 0.00119684, 0.00377998, 0.00027006 ] ]
pbe
true
15
agm005266151-pbe-492
492
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27183717, 7.94168545, 0.08597501 ], [ -3.27183717, 7.94168545, 0.08597501 ], [ 0, 4.45997224, 6.19281418 ] ]
agm005266151
[ [ 1.635918585, 3.970842725, 0.042987505 ], [ -1.635918585, 6.200828845, 3.139394595 ], [ 0.7650158957417865, 4.151521816900807, 2.764020086640807 ], [ 0.7650158957417865, 13.961835203099191, 0.5043370233591933 ], [ -0.7650158957417865, 16.19182132309919, 3.6007441133591933 ], [ -0.7650158957417865, 6.381507936900808, 5.860427176640807 ], [ -2.4922824404544865, 11.52382847908778, 4.1708118787664565 ], [ -2.4922824404544865, 11.049500780912222, 5.290359411233543 ], [ 2.4922824404544865, 8.819514660912223, 2.1939523212335437 ], [ 2.4922824404544865, 9.293842359087778, 1.074404788766457 ], [ -1.859875054045579, 11.399443414644383, 1.974087202345183 ], [ -1.8598750540455793, 6.713913605355616, 1.2942699076548172 ], [ 1.8598750540455793, 8.943899725355616, 4.3906769976548174 ], [ 1.859875054045579, 13.629429534644382, 5.070494292345183 ], [ 0.17163730610103, 5.239084050819861, 2.5376839333742045 ], [ 0.17163730610103034, 12.874272969180137, 0.7306731766257955 ], [ -0.17163730610103034, 15.104259089180136, 3.8270802666257953 ], [ -0.17163730610103, 7.469070170819862, 5.634091023374205 ], [ -0.7769770126311291, 14.865165948834097, 6.140806857314789 ], [ -0.7769770126311292, 7.708163311165903, 3.3203644326852113 ], [ 0.7769770126311292, 5.478177191165903, 0.2239573426852115 ], [ 0.7769770126311291, 12.635179828834096, 3.0443997673147885 ] ]
[{"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 ]
[ [ -0.17208355, 0, 0 ], [ 0, -0.13735163, -0.18320539 ], [ 0, -0.18320545, 0.05915045 ] ]
-146.984411
-158.504411
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00146695, -0.00451098, 0.00285092 ], [ 0.00146695, 0.00451098, -0.00285092 ], [ -0.00146695, 0.00451098, -0.00285092 ], [ -0.00146695, -0.00451098, 0.00285092 ], [ -0.00115526, 0.00245246, -0.0019223 ], [ -0.00115526, -0.00245246, 0.0019223 ], [ 0.00115526, -0.00245246, 0.0019223 ], [ 0.00115526, 0.00245246, -0.0019223 ], [ -0.00405481, 0.00345446, -0.00056637 ], [ -0.00405481, -0.00345446, 0.00056637 ], [ 0.00405481, -0.00345446, 0.00056637 ], [ 0.00405481, 0.00345446, -0.00056637 ], [ -0.00658329, 0.00077989, -0.00218182 ], [ -0.00658329, -0.00077989, 0.00218182 ], [ 0.00658329, -0.00077989, 0.00218182 ], [ 0.00658329, 0.00077989, -0.00218182 ], [ -0.00062992, 0.0034555, 0.00030712 ], [ -0.00062992, -0.0034555, -0.00030712 ], [ 0.00062992, -0.0034555, -0.00030712 ], [ 0.00062992, 0.0034555, 0.00030712 ] ]
pbe
true
15
agm005266151-pbe-493
493
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27196301, 7.94136109, 0.08592599 ], [ -3.27196301, 7.94136109, 0.08592599 ], [ 0, 4.4597518, 6.19281952 ] ]
agm005266151
[ [ 1.635981505, 3.970680545, 0.042962995 ], [ -1.635981505, 6.200556445, 3.1393727549999997 ], [ 0.7649386861810386, 4.151348847674257, 2.7639915795992946 ], [ 0.7649386861810386, 13.961249232325743, 0.5042701604007049 ], [ -0.7649386861810386, 16.191125132325745, 3.600679920400705 ], [ -0.7649386861810386, 6.381224747674257, 5.860401339599295 ], [ -2.4924029681554343, 11.523324431255404, 4.170787803212918 ], [ -2.4924029681554343, 11.049025448744597, 5.290293456787081 ], [ 2.4924029681554343, 8.819149548744598, 2.193883696787081 ], [ 2.4924029681554343, 9.293448531255402, 1.0743780432129189 ], [ -1.8599535243249585, 11.398924085740978, 1.9739683392514427 ], [ -1.8599535243249588, 6.713673994259023, 1.294293400748557 ], [ 1.8599535243249588, 8.943549894259023, 4.390703160748557 ], [ 1.8599535243249585, 13.62879998574098, 5.0703780992514424 ], [ 0.17147576136250609, 5.238703752626808, 2.537555274338525 ], [ 0.17147576136250642, 12.873894327373192, 0.7307064656614746 ], [ -0.17147576136250642, 15.103770227373191, 3.827116225661474 ], [ -0.17147576136250609, 7.46857965262681, 5.633965034338525 ], [ -0.7769372690153795, 14.864592914680266, 6.140740919271448 ], [ -0.7769372690153795, 7.707756965319735, 3.320340340728551 ], [ 0.7769372690153795, 5.477881065319735, 0.2239305807285513 ], [ 0.7769372690153795, 12.634717014680264, 3.0443311592714486 ] ]
[{"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 ]
[ [ -0.12830467, 0, 0 ], [ 0, 0.02134699, -0.23075014 ], [ 0, -0.23075017, 0.02431067 ] ]
-146.984412
-158.504412
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.0057833, -0.01142777, 0.00187015 ], [ 0.0057833, 0.01142777, -0.00187015 ], [ -0.0057833, 0.01142777, -0.00187015 ], [ -0.0057833, -0.01142777, 0.00187015 ], [ -0.00083082, 0.00466572, -0.0077624 ], [ -0.00083082, -0.00466572, 0.0077624 ], [ 0.00083082, -0.00466572, 0.0077624 ], [ 0.00083082, 0.00466572, -0.0077624 ], [ -0.00543382, 0.00503083, 0.00258136 ], [ -0.00543382, -0.00503083, -0.00258136 ], [ 0.00543382, -0.00503083, -0.00258136 ], [ 0.00543382, 0.00503083, 0.00258136 ], [ -0.00855306, 0.0056338, -0.00271199 ], [ -0.00855306, -0.0056338, 0.00271199 ], [ 0.00855306, -0.0056338, 0.00271199 ], [ 0.00855306, 0.0056338, -0.00271199 ], [ -0.00009465, 0.00182183, 0.00031953 ], [ -0.00009465, -0.00182183, -0.00031953 ], [ 0.00009465, -0.00182183, -0.00031953 ], [ 0.00009465, 0.00182183, 0.00031953 ] ]
pbe
true
15
agm005266151-pbe-494
494
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27192535, 7.94145817, 0.08594066 ], [ -3.27192535, 7.94145817, 0.08594066 ], [ 0, 4.45981778, 6.19281792 ] ]
agm005266151
[ [ 1.635962675, 3.970729085, 0.04297033 ], [ -1.635962675, 6.200637974999999, 3.1393792900000004 ], [ 0.7649617830777136, 4.151400641490266, 2.764000135404944 ], [ 0.7649617830777133, 13.961424588509734, 0.5042901445950563 ], [ -0.7649617830777133, 16.191333478509733, 3.6006991045950567 ], [ -0.7649617830777136, 6.381309531490265, 5.860409095404944 ], [ -2.4923669189893736, 11.52347533713422, 4.170795019367426 ], [ -2.4923669189893736, 11.049167672865778, 5.290313180632574 ], [ 2.4923669189893736, 8.819258782865779, 2.1939042206325743 ], [ 2.4923669189893736, 9.29356644713422, 1.074386059367426 ], [ -1.8599300223949342, 11.399079461702513, 1.9740038969563911 ], [ -1.8599300223949342, 6.713745768297487, 1.294286383043609 ], [ 1.8599300223949342, 8.943654658297488, 4.390695343043609 ], [ 1.8599300223949342, 13.628988351702514, 5.070412856956391 ], [ 0.17152410990379652, 5.23881763945272, 2.5375937891617206 ], [ 0.17152410990379696, 12.87400759054728, 0.730696490838279 ], [ -0.17152410990379696, 15.103916480547278, 3.827105450838279 ], [ -0.17152410990379652, 7.46872652945272, 5.634002749161722 ], [ -0.7769491687017622, 14.864764506967557, 6.140760662589841 ], [ -0.776949168701762, 7.707878503032443, 3.3203475374101603 ], [ 0.776949168701762, 5.477969613032443, 0.2239385774101596 ], [ 0.7769491687017622, 12.634855616967556, 3.044351702589841 ] ]
[{"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 ]
[ [ -0.14329552, 0, 0 ], [ 0, -0.0275523, -0.21405025 ], [ 0, -0.21405031, 0.03541734 ] ]
-146.984412
-158.504412
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00419341, -0.00928928, 0.00217902 ], [ 0.00419341, 0.00928928, -0.00217902 ], [ -0.00419341, 0.00928928, -0.00217902 ], [ -0.00419341, -0.00928928, 0.00217902 ], [ -0.00093949, 0.00401884, -0.006074 ], [ -0.00093949, -0.00401884, 0.006074 ], [ 0.00093949, -0.00401884, 0.006074 ], [ 0.00093949, 0.00401884, -0.006074 ], [ -0.00496699, 0.0046434, 0.00167776 ], [ -0.00496699, -0.0046434, -0.00167776 ], [ 0.00496699, -0.0046434, -0.00167776 ], [ 0.00496699, 0.0046434, 0.00167776 ], [ -0.00751063, 0.00452712, -0.00222778 ], [ -0.00751063, -0.00452712, 0.00222778 ], [ 0.00751063, -0.00452712, 0.00222778 ], [ 0.00751063, 0.00452712, -0.00222778 ], [ -0.00065444, 0.00193289, 0.00029797 ], [ -0.00065444, -0.00193289, -0.00029797 ], [ 0.00065444, -0.00193289, -0.00029797 ], [ 0.00065444, 0.00193289, 0.00029797 ] ]
pbe
true
15
agm005266151-pbe-495
495
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27200358, 7.94118123, 0.08581222 ], [ -3.27200358, 7.94118123, 0.08581222 ], [ 0, 4.45956247, 6.19278395 ] ]
agm005266151
[ [ 1.63600179, 3.970590615, 0.04290611 ], [ -1.63600179, 6.20037185, 3.139298085 ], [ 0.7649172177195119, 4.151169290433061, 2.7639481925533995 ], [ 0.7649172177195118, 13.960974404566938, 0.5040682224466004 ], [ -0.7649172177195118, 16.190755639566937, 3.6004601974466004 ], [ -0.7649172177195119, 6.380950525433061, 5.8603401675533995 ], [ -2.4924520317886154, 11.523024137517533, 4.170619511026118 ], [ -2.4924520317886154, 11.048682027482466, 5.290180853973881 ], [ 2.4924520317886154, 8.818900792482466, 2.193788878973882 ], [ 2.4924520317886154, 9.293242902517534, 1.074227536026118 ], [ -1.860008750212922, 11.398644149732835, 1.9737930330928914 ], [ -1.8600087502129214, 6.713499545267165, 1.2942233819071087 ], [ 1.8600087502129214, 8.943280780267166, 4.390615356907109 ], [ 1.860008750212922, 13.628425384732836, 5.070185008092891 ], [ 0.1713478253969387, 5.238497625044788, 2.5374222173138783 ], [ 0.1713478253969387, 12.873646069955209, 0.7305941976861214 ], [ -0.1713478253969387, 15.10342730495521, 3.8269861726861216 ], [ -0.1713478253969387, 7.468278860044789, 5.633814192313878 ], [ -0.7769147386863695, 14.86421829928203, 6.140554018858812 ], [ -0.7769147386863695, 7.707487865717971, 3.320246346141188 ], [ 0.7769147386863695, 5.477706630717971, 0.22385437114118828 ], [ 0.7769147386863695, 12.634437064282029, 3.0441620438588113 ] ]
[{"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 ]
[ [ -0.13382921, 0, 0 ], [ 0, 0.00470229, -0.18308774 ], [ 0, -0.18308771, -0.03484858 ] ]
-146.984419
-158.504419
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00431186, -0.00871381, 0.00066208 ], [ 0.00431186, 0.00871381, -0.00066208 ], [ -0.00431186, 0.00871381, -0.00066208 ], [ -0.00431186, -0.00871381, 0.00066208 ], [ -0.000841, 0.00188477, -0.00117852 ], [ -0.000841, -0.00188477, 0.00117852 ], [ 0.000841, -0.00188477, 0.00117852 ], [ 0.000841, 0.00188477, -0.00117852 ], [ -0.00479549, 0.00398301, 0.00261846 ], [ -0.00479549, -0.00398301, -0.00261846 ], [ 0.00479549, -0.00398301, -0.00261846 ], [ 0.00479549, 0.00398301, 0.00261846 ], [ -0.00800635, 0.00391591, -0.00172904 ], [ -0.00800635, -0.00391591, 0.00172904 ], [ 0.00800635, -0.00391591, 0.00172904 ], [ 0.00800635, 0.00391591, -0.00172904 ], [ 0.00060674, 0.00092204, 0.00025596 ], [ 0.00060674, -0.00092204, -0.00025596 ], [ -0.00060674, -0.00092204, -0.00025596 ], [ -0.00060674, 0.00092204, 0.00025596 ] ]
pbe
true
15
agm005266151-pbe-496
496
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27223827, 7.94035041, 0.08542692 ], [ -3.27223827, 7.94035041, 0.08542692 ], [ 0, 4.45879653, 6.19268204 ] ]
agm005266151
[ [ 1.636119135, 3.970175205, 0.04271346 ], [ -1.636119135, 6.19957347, 3.13905448 ], [ 0.7647835690560932, 4.150475295417744, 2.7637924395523576 ], [ 0.7647835690560933, 13.959623789582256, 0.5034024204476424 ], [ -0.7647835690560933, 16.189022054582257, 3.5997434404476425 ], [ -0.7647835690560932, 6.379873560417743, 5.860133459552358 ], [ -2.492707442953436, 11.52167068685679, 4.170093005084571 ], [ -2.492707442953436, 11.04722492814321, 5.28978389491543 ], [ 2.492707442953436, 8.81782666314321, 2.1934428749154296 ], [ 2.492707442953436, 9.29227242185679, 1.0737519850845705 ], [ -1.8602449107733199, 11.397337938641911, 1.9731604010152624 ], [ -1.8602449107733194, 6.7127611463580905, 1.2940344589847377 ], [ 1.8602449107733194, 8.942159411358091, 4.390375478984738 ], [ 1.8602449107733199, 13.62673620364191, 5.069501421015263 ], [ 0.17081895284490956, 5.237537920912182, 2.5369075862098853 ], [ 0.17081895284490978, 12.872561164087816, 0.7302872737901148 ], [ -0.17081895284490978, 15.101959429087817, 3.826628293790115 ], [ -0.17081895284490956, 7.466936185912182, 5.633248606209885 ], [ -0.7768113352651325, 14.862579717707794, 6.139934101273296 ], [ -0.7768113352651324, 7.706315897292205, 3.319942798726705 ], [ 0.7768113352651324, 5.476917632292205, 0.2236017787267052 ], [ 0.7768113352651325, 12.633181452707793, 3.0435930812732948 ] ]
[{"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 ]
[ [ -0.03915546, 0, 0 ], [ 0, 0.19041146, -0.08846284 ], [ 0, -0.08846284, -0.16428439 ] ]
-146.984431
-158.504431
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.003275, -0.0074527, -0.00459313 ], [ 0.003275, 0.0074527, 0.00459313 ], [ -0.003275, 0.0074527, 0.00459313 ], [ -0.003275, -0.0074527, -0.00459313 ], [ -0.0006324, -0.00456496, 0.0132705 ], [ -0.0006324, 0.00456496, -0.0132705 ], [ 0.0006324, 0.00456496, -0.0132705 ], [ 0.0006324, -0.00456496, 0.0132705 ], [ -0.00407474, 0.00233728, 0.0053151 ], [ -0.00407474, -0.00233728, -0.0053151 ], [ 0.00407474, -0.00233728, -0.0053151 ], [ 0.00407474, 0.00233728, 0.0053151 ], [ -0.00739071, 0.00393159, 0.00077439 ], [ -0.00739071, -0.00393159, -0.00077439 ], [ 0.00739071, -0.00393159, -0.00077439 ], [ 0.00739071, 0.00393159, 0.00077439 ], [ 0.00227932, -0.00326878, 0.00007433 ], [ 0.00227932, 0.00326878, -0.00007433 ], [ -0.00227932, 0.00326878, -0.00007433 ], [ -0.00227932, -0.00326878, 0.00007433 ] ]
pbe
true
15
agm005266151-pbe-497
497
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27232959, 7.94009384, 0.08521824 ], [ -3.27232959, 7.94009384, 0.08521824 ], [ 0, 4.45849113, 6.19254934 ] ]
agm005266151
[ [ 1.636164795, 3.97004692, 0.04260912 ], [ -1.636164795, 6.199292485, 3.13888379 ], [ 0.7647479737211301, 4.150163618356946, 2.7636421729424563 ], [ 0.7647479737211302, 13.959269626643053, 0.5030689770575443 ], [ -0.7647479737211302, 16.188515191643052, 3.5993436470575446 ], [ -0.7647479737211301, 6.379409183356946, 5.8599168429424555 ], [ -2.492813887348863, 11.521181169195149, 4.169854771814752 ], [ -2.492813887348863, 11.046743205804852, 5.2894057181852485 ], [ 2.492813887348863, 8.817497640804852, 2.193131048185248 ], [ 2.492813887348863, 9.29193560419515, 1.073580101814752 ], [ -1.8603688495384008, 11.396927496661784, 1.9728450800171995 ], [ -1.8603688495384012, 6.712505748338217, 1.2938660699828006 ], [ 1.8603688495384012, 8.941751313338218, 4.390140739982801 ], [ 1.8603688495384008, 13.626173061661783, 5.069119750017199 ], [ 0.17054265958689807, 5.237207829181994, 2.5366391381559277 ], [ 0.17054265958689818, 12.872225415818006, 0.7300720118440722 ], [ -0.17054265958689818, 15.101470980818005, 3.8263466818440723 ], [ -0.17054265958689807, 7.466453394181993, 5.632913808155928 ], [ -0.7767496678953019, 14.862007740688327, 6.139524610673766 ], [ -0.7767496678953016, 7.705916634311674, 3.3197358793262337 ], [ 0.7767496678953016, 5.476671069311673, 0.22346120932623378 ], [ 0.7767496678953019, 12.632762175688327, 3.0432499406737663 ] ]
[{"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 ]
[ [ -0.02794191, 0, 0 ], [ 0, 0.16371503, -0.04752135 ], [ 0, -0.0475213, -0.04260663 ] ]
-146.98444
-158.50444
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00124691, -0.00178128, -0.00196818 ], [ -0.00124691, 0.00178128, 0.00196818 ], [ 0.00124691, 0.00178128, 0.00196818 ], [ 0.00124691, -0.00178128, -0.00196818 ], [ -0.00048333, 0.00131871, -0.00048939 ], [ -0.00048333, -0.00131871, 0.00048939 ], [ 0.00048333, -0.00131871, 0.00048939 ], [ 0.00048333, 0.00131871, -0.00048939 ], [ -0.00188155, 0.00019667, 0.00425835 ], [ -0.00188155, -0.00019667, -0.00425835 ], [ 0.00188155, -0.00019667, -0.00425835 ], [ 0.00188155, 0.00019667, 0.00425835 ], [ -0.00468866, -0.00083237, 0.00250242 ], [ -0.00468866, 0.00083237, -0.00250242 ], [ 0.00468866, 0.00083237, -0.00250242 ], [ 0.00468866, -0.00083237, 0.00250242 ], [ 0.0030599, -0.00434941, -0.00005656 ], [ 0.0030599, 0.00434941, 0.00005656 ], [ -0.0030599, 0.00434941, 0.00005656 ], [ -0.0030599, -0.00434941, -0.00005656 ] ]
pbe
true
15
agm005266151-pbe-498
498
2
[ "C", "Co", "O" ]
22
A6B4C
C4CoO6
Co2 C8 O12
3
[ 1, 1, 1 ]
3
[ [ 3.27238045, 7.93995096, 0.08510203 ], [ -3.27238045, 7.93995096, 0.08510203 ], [ 0, 4.45832106, 6.19247544 ] ]
agm005266151
[ [ 1.636190225, 3.96997548, 0.042551015 ], [ -1.636190225, 6.19913601, 3.138788735 ], [ 0.7647281176834606, 4.149990072630223, 2.7635585381221395 ], [ 0.7647281176834606, 13.959072377369777, 0.5028832418778605 ], [ -0.7647281176834606, 16.188232907369777, 3.5991209618778606 ], [ -0.7647281176834606, 6.379150602630222, 5.859796258122139 ], [ -2.4928732150425956, 11.520908472645992, 4.1697220505217505 ], [ -2.492873215042595, 11.046475037354007, 5.2891951694782495 ], [ 2.492873215042595, 8.817314507354007, 2.192957449478249 ], [ 2.4928732150425956, 9.291747942645992, 1.0734843305217507 ], [ -1.8604378836017212, 11.39669890684893, 1.9726694429320524 ], [ -1.860437883601721, 6.712363543151069, 1.2937723370679475 ], [ 1.860437883601721, 8.941524073151069, 4.390010057067948 ], [ 1.8604378836017212, 13.62585943684893, 5.068907162932053 ], [ 0.17038879227974213, 5.237024018207526, 2.5364896665750787 ], [ 0.17038879227974224, 12.872038431792474, 0.7299521134249212 ], [ -0.17038879227974224, 15.101198961792473, 3.826189833424921 ], [ -0.17038879227974213, 7.466184548207527, 5.632727386575079 ], [ -0.7767153054050733, 14.86168911883666, 6.139296608767205 ], [ -0.7767153054050733, 7.705694391163339, 3.3196206112327937 ], [ 0.7767153054050733, 5.47653386116334, 0.2233828912327941 ], [ 0.7767153054050733, 12.63252858883666, 3.043058888767206 ] ]
[{"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 ]
[ [ -0.04482581, 0, 0 ], [ 0, 0.11806711, -0.02773858 ], [ 0, -0.02773864, 0.00062721 ] ]
-146.98444
-158.50444
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ -0.00390031, 0.00155069, -0.00047802 ], [ -0.00390031, -0.00155069, 0.00047802 ], [ 0.00390031, -0.00155069, 0.00047802 ], [ 0.00390031, 0.00155069, -0.00047802 ], [ -0.00068945, 0.00467409, -0.00821797 ], [ -0.00068945, -0.00467409, 0.00821797 ], [ 0.00068945, -0.00467409, 0.00821797 ], [ 0.00068945, 0.00467409, -0.00821797 ], [ -0.00107539, -0.00122292, 0.00362238 ], [ -0.00107539, 0.00122292, -0.00362238 ], [ 0.00107539, 0.00122292, -0.00362238 ], [ 0.00107539, -0.00122292, 0.00362238 ], [ -0.00338841, -0.00391177, 0.00349004 ], [ -0.00338841, 0.00391177, -0.00349004 ], [ 0.00338841, 0.00391177, -0.00349004 ], [ 0.00338841, -0.00391177, 0.00349004 ], [ 0.0036197, -0.00490043, -0.00005047 ], [ 0.0036197, 0.00490043, 0.00005047 ], [ -0.0036197, 0.00490043, 0.00005047 ], [ -0.0036197, -0.00490043, -0.00005047 ] ]
pbe
true
15
agm005266151-pbe-499
499
2