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[
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[
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[
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[
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[
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[
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[
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],
[
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[
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[
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[
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],
[
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[
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[
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[
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],
[
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],
[
5.32387056,
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],
[
4.02879146,
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],
[
4.96682971,
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],
[
3.66319337,
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],
[
5.53361542,
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],
[
5.81733092,
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],
[
5.19404527,
3.07940117,
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],
[
6.05369831,
5.21146355,
-2.67710067
]
] |
[
false,
false,
false
] |
C14H12
|
C7H6
|
A7B6
|
[
"C",
"H"
] |
[
0.5384615384615384,
0.46153846153846156
] |
[
6,
6,
6,
6,
6,
6,
1,
1,
1,
1,
1,
6,
1,
6,
1,
6,
6,
6,
6,
1,
6,
1,
6,
1,
1,
1
] | 26
| 2
| 0
|
[
0,
0,
0
] |
[
"xxMD-CASSCF_stilbene_val_state2_3549",
"xxMD-CASSCF_stilbene_val_state1_3549",
"xxMD-CASSCF_stilbene_val_state0_3549",
"xxMD-DFT_stilbene_val_3548"
] | null |
data/MD/5202/MD_1086845055867124744315202.json
| null | null | null |
{"hash": "10868450558671247443152026947160338505683745266658651051718065983487878962987857602829315249215796444208488632888003673539585986066311769564391053988452926", "id": "MD_1086845055867124744315202"}
|
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