id
string | hash
string | last_modified
timestamp[ns] | dataset_ids
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list | nsites
int32 | nelements
int32 | nperiodic_dimensions
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list | dimension_types
list | pbc
list | names
list | labels
list | metadata_id
string | metadata_path
string | metadata_size
int32 | structure_hash
string | positions_00
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2.85542216
]
] |
CO_3333994907085972230119137
|
3333994907085972230119137962184252674473007911117670469760359214759639928060314440035981114552940185387136750064338329829355182254203965540546954299912039
| 2025-05-14T22:34:44 | null |
C6
|
C
|
A
|
[
"C"
] |
[
1
] |
[
6,
6,
6,
6,
6,
6
] | 6 | 1 | 3 |
[
[
2.3816772128022903,
0,
-0.718377289186062
],
[
-0.4330675974444049,
3.1801166895577437,
-1.4351787499959827
],
[
0,
0,
4.30432
]
] |
[
1,
1,
1
] |
[
true,
true,
true
] |
[
"carbon_NXL_351"
] | null | null | null | null |
10453158046169721461856013205569041857926317910838614915383370723230708485534798895793907656348680978323509564359066645726577878020495031256725658097985127
|
[
[
0.7732085,
2.26452347,
0.11002352
],
[
1.85578074,
3.06084085,
-0.60858672
],
[
0.12334069,
1.20448147,
2.26279373
],
[
0.55653256,
0.94075175,
-0.60757624
],
[
1.20591291,
2.00079885,
1.5441835
],
[
1.85565646,
0.14445387,
-0.60735804
]
] |
CO_4770401959465669200003969
|
4770401959465669200003969527144210496422351475033106396724345011897641128302403750322621343047796526838690593242942872232213178028871512763080133830631192
| 2025-05-14T22:34:44 | null |
C6
|
C
|
A
|
[
"C"
] |
[
1
] |
[
6,
6,
6,
6,
6,
6
] | 6 | 1 | 3 |
[
[
2.3810609112065926,
0,
-0.7183081787255589
],
[
-0.43399840565974807,
3.1805318680950765,
-1.4356189285518774
],
[
0,
0,
4.304014409027203
]
] |
[
1,
1,
1
] |
[
true,
true,
true
] |
[
"carbon_NXL_352"
] | null | null | null | null |
1258431857846004464363398796765474915710120471827357438798348440418459087951379477554628259606985107663733644871623956115602672631438541159906657576139611
|
[
[
1.1653633,
0.98477724,
1.11208291
],
[
0.08234407,
3.10513179,
1.82911119
],
[
1.81438415,
2.04495452,
-1.04056425
],
[
0.51518663,
2.84060521,
-1.04086929
],
[
-0.13383417,
1.7804279,
1.11177791
],
[
1.59820589,
0.72025062,
2.54611689
]
] |
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