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{
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{
"id": "jvasp-115477",
"created_at": "2022-09-04T14:38:48.526185Z",
"updated_at": "2022-09-04T14:38:48.526211Z",
"structure_string": "B2 Br2 N2\n1.0\n2.648200 0.000000 0.000000\n0.000000 3.094928 0.000000\n0.000000 0.000000 10.611844\nB Br N\n2 2 2\ndirect\n0.500001 0.000000 0.012732 B\n0.000000 0.500001 0.987268 B\n0.500001 0.500001 0.657733 Br\n0.000000 0.000000 0.342266 Br\n0.500001 0.500001 0.061734 N\n0.000000 0.000000 0.938265 N\n",
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{
"id": "jvasp-115480",
"created_at": "2022-09-04T14:38:50.298475Z",
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"structure_string": "B2 Br2\n1.0\n5.438144 0.415854 0.553375\n-0.653265 -6.085429 -0.024879\n-1.564682 -0.667219 -2.721929\nB Br\n2 2\ndirect\n0.167533 0.047864 -0.037032 B\n0.361903 0.842185 0.260019 B\n0.533445 0.675213 0.014878 Br\n-0.004033 0.214822 0.208097 Br\n",
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{
"id": "jvasp-114472",
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"updated_at": "2022-09-04T14:38:41.198159Z",
"structure_string": "B2 Br2\n1.0\n3.052327 -0.000000 0.000000\n-0.000000 3.052327 -0.000000\n-0.000000 -0.000000 7.557784\nB Br\n2 2\ndirect\n0.000000 -0.000000 -0.042295 B\n0.500001 0.500001 0.042295 B\n0.000000 0.000000 0.703590 Br\n0.500001 0.500001 0.296409 Br\n",
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"density": 4.27859920015879,
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},
{
"id": "jvasp-114465",
"created_at": "2022-09-04T14:38:41.141738Z",
"updated_at": "2022-09-04T14:38:41.141774Z",
"structure_string": "B2 Br1\n1.0\n8.328137 0.000000 -4.397166\n0.000000 3.421533 0.000000\n-5.119897 0.000000 4.749852\nB Br\n2 1\ndirect\n-0.212842 0.000000 -0.331060 B\n0.292830 0.000000 0.173670 B\n0.082231 0.000000 0.345612 Br\n",
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"density": 2.8908423092075126,
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"volume": 58.31791265081068,
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"formula_full": "B2 Br1",
"formula_reduced": "B2Br",
"formula_anonymous": "AB2",
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"spacegroup": 6
},
{
"id": "jvasp-114464",
"created_at": "2022-09-04T14:38:41.872450Z",
"updated_at": "2022-09-04T14:38:41.872477Z",
"structure_string": "B2 Br1\n1.0\n5.315384 0.000000 0.000000\n0.000000 3.315730 0.000000\n0.000000 0.000000 3.234186\nB Br\n2 1\ndirect\n0.007229 0.000000 0.753345 B\n0.007229 0.000000 0.246656 B\n0.385542 0.000000 0.000000 Br\n",
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"elements": [
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"density": 2.957655431066766,
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"volume": 57.00051720183827,
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"spacegroup": 25
},
{
"id": "jvasp-114461",
"created_at": "2022-09-04T14:38:40.858821Z",
"updated_at": "2022-09-04T14:38:40.858850Z",
"structure_string": "B2 Br1\n1.0\n3.233011 -0.026346 0.171114\n-1.600506 -3.106609 0.024008\n0.332727 -1.844958 -5.037590\nB Br\n2 1\ndirect\n0.731419 0.059233 0.426686 B\n0.223899 0.059854 0.426532 B\n0.865794 0.849981 0.822906 Br\n",
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"density": 3.2650805049808396,
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"volume": 51.6336087329096,
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"spacegroup": 8
},
{
"id": "jvasp-4708",
"created_at": "2022-09-04T14:37:54.820474Z",
"updated_at": "2022-09-04T14:37:54.820493Z",
"structure_string": "B2 Au1\n1.0\n1.490465 -2.581560 0.000000\n1.490465 2.581560 0.000000\n-0.000000 -0.000000 4.427732\nB Au\n2 1\ndirect\n0.666669 0.333335 0.500000 B\n0.333335 0.666669 0.500000 B\n0.000000 0.000000 0.000000 Au\n",
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"elements": [
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"volume": 34.07338867323598,
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"formula_full": "B2 Au1",
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"spacegroup": 191
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{
"id": "jvasp-16304",
"created_at": "2022-09-04T14:38:26.747135Z",
"updated_at": "2022-09-04T14:38:26.747156Z",
"structure_string": "B2 Au1\n1.0\n1.490465 -2.581560 0.000000\n1.490465 2.581560 -0.000000\n0.000000 0.000000 4.427732\nB Au\n2 1\ndirect\n0.666669 0.333335 0.500000 B\n0.333335 0.666669 0.500000 B\n0.000000 0.000000 0.000000 Au\n",
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},
{
"id": "jvasp-111697",
"created_at": "2022-09-04T14:38:52.174981Z",
"updated_at": "2022-09-04T14:38:52.174991Z",
"structure_string": "B2 As2 H8 N2 O8 F2\n1.0\n4.652745 -0.006223 0.002147\n-2.508561 3.918570 0.002147\n-0.003292 -0.006006 12.624072\nB As H N O F\n2 2 8 2 8 2\ndirect\n0.570096 0.249280 0.689754 B\n0.249280 0.570095 0.189754 B\n0.900632 0.934138 0.772984 As\n0.934139 0.900631 0.272985 As\n0.636447 0.327746 0.075433 H\n0.254010 0.426552 0.459256 H\n0.426553 0.254009 0.959255 H\n0.327746 0.636446 0.575432 H\n0.801852 0.628808 0.978372 H\n0.263628 0.798017 0.463344 H\n0.798019 0.263627 0.963344 H\n0.628809 0.801851 0.478372 H\n0.666928 0.368835 0.994891 N\n0.368836 0.666927 0.494891 N\n0.766833 0.506436 0.771927 O\n0.506437 0.766832 0.271927 O\n0.553428 0.933820 0.721284 O\n0.933822 0.553428 0.221284 O\n0.215414 0.161431 0.678007 O\n0.161432 0.215413 0.178007 O\n0.004389 0.063268 0.899015 O\n0.063269 0.004388 0.399015 O\n0.721852 0.366768 0.588465 F\n0.366768 0.721851 0.088465 F\n",
"nsites": 24,
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{
"id": "jvasp-37905",
"created_at": "2022-09-04T14:37:53.599750Z",
"updated_at": "2022-09-04T14:37:53.599766Z",
"structure_string": "B2 As2\n1.0\n1.694220 -2.934476 0.000000\n1.694220 2.934476 -0.000000\n0.000000 -0.000000 5.613945\nB As\n2 2\ndirect\n0.333333 0.666667 0.374522 B\n0.666667 0.333333 0.874522 B\n0.333333 0.666667 0.000478 As\n0.666667 0.333333 0.500478 As\n",
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},
{
"id": "jvasp-115282",
"created_at": "2022-09-04T14:38:44.038398Z",
"updated_at": "2022-09-04T14:38:44.038424Z",
"structure_string": "B2 As1 P1\n1.0\n3.311929 0.000000 0.000000\n0.000000 3.311929 -0.000000\n0.000000 0.000000 4.692861\nB As P\n2 1 1\ndirect\n0.500000 0.000000 0.763861 B\n0.000000 0.500000 0.236138 B\n0.000000 0.000000 0.499999 As\n0.500000 0.500000 0.000000 P\n",
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{
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}