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{
"id": "jvasp-26811",
"created_at": "2022-09-04T14:38:31.751993Z",
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"structure_string": "Na8 B4 H4 O12\n1.0\n3.464257 0.000000 0.000000\n-0.000000 8.638477 0.000000\n0.000000 0.000000 9.909153\nNa B H O\n8 4 4 12\ndirect\n0.250000 0.571091 0.102650 Na\n0.750001 0.428909 0.897350 Na\n0.750001 0.828000 0.946341 Na\n0.750001 0.928909 0.602650 Na\n0.750001 0.328000 0.553659 Na\n0.250000 0.672000 0.446341 Na\n0.250000 0.172000 0.053659 Na\n0.250000 0.071091 0.397350 Na\n0.250000 0.635575 0.740410 B\n0.250000 0.135575 0.759590 B\n0.750001 0.364425 0.259590 B\n0.750001 0.864425 0.240410 B\n0.750001 0.600651 0.270353 H\n0.750001 0.100651 0.229646 H\n0.250000 0.899349 0.770353 H\n0.250000 0.399349 0.729646 H\n0.750001 0.506673 0.336648 O\n0.250000 0.628131 0.877931 O\n0.250000 0.493327 0.663352 O\n0.750001 0.371870 0.122069 O\n0.250000 0.769097 0.666978 O\n0.250000 0.993328 0.836647 O\n0.750001 0.230903 0.333022 O\n0.250000 0.128130 0.622069 O\n0.750001 0.730903 0.166978 O\n0.750001 0.871870 0.377931 O\n0.750001 0.006673 0.163352 O\n0.250000 0.269097 0.833021 O\n",
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{
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"structure_string": "Li1 In1 I4 O12\n1.0\n4.859398 -0.000537 -0.002564\n0.074789 6.502526 -0.018558\n0.114977 0.741456 8.585878\nLi In I O\n1 1 4 12\ndirect\n0.500000 0.000000 0.500000 Li\n0.500001 0.500000 0.500000 In\n0.513692 0.802127 0.157730 I\n0.009238 0.280291 0.235934 I\n0.990764 0.719710 0.764067 I\n0.486309 0.197874 0.842271 I\n0.777384 0.508361 0.694273 O\n0.777655 0.936632 0.690682 O\n0.350890 0.230175 0.637712 O\n0.243662 0.734383 0.601528 O\n0.756339 0.265617 0.398473 O\n0.222617 0.491640 0.305727 O\n0.222346 0.063369 0.309319 O\n0.288057 0.960495 0.899189 O\n0.711944 0.039506 0.100811 O\n0.746597 0.619665 0.071202 O\n0.649112 0.769826 0.362289 O\n0.253404 0.380335 0.928798 O\n",
"nsites": 18,
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{
"id": "jvasp-110382",
"created_at": "2022-09-04T14:38:39.350875Z",
"updated_at": "2022-09-04T14:38:39.350904Z",
"structure_string": "Rb2 Li1 Pr1 Br6\n1.0\n6.790114 -0.000000 3.920275\n2.263372 6.401781 3.920275\n-0.000000 -0.000000 7.840548\nRb Li Pr Br\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.740696 0.259304 0.259304 Br\n0.259304 0.259304 0.740696 Br\n0.259304 0.740696 0.740696 Br\n0.259304 0.740696 0.259304 Br\n0.740696 0.259304 0.740696 Br\n0.740695 0.740696 0.259304 Br\n",
"nsites": 10,
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{
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"created_at": "2022-09-04T14:38:37.909238Z",
"updated_at": "2022-09-04T14:38:37.909260Z",
"structure_string": "Pr4 Mg2 Ir2 O12\n1.0\n5.728567 0.000000 0.000000\n0.000000 4.519007 3.179031\n0.000000 -0.011216 9.640763\nPr Mg Ir O\n4 2 2 12\ndirect\n0.556799 0.235303 0.750618 Pr\n0.943202 0.235304 0.250618 Pr\n0.443202 0.764696 0.249381 Pr\n0.056798 0.764696 0.749381 Pr\n0.500000 -0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Ir\n0.500000 0.500000 -0.000000 Ir\n0.206941 0.253088 0.047764 O\n0.293059 0.253088 0.547764 O\n0.476187 0.659072 0.750960 O\n0.023813 0.659072 0.250960 O\n0.523813 0.340928 0.249040 O\n0.704353 0.156131 0.047469 O\n0.295648 0.843868 0.952531 O\n0.204353 0.843869 0.452531 O\n0.706941 0.746912 0.452236 O\n0.795648 0.156131 0.547469 O\n0.976188 0.340928 0.749040 O\n0.793059 0.746912 0.952236 O\n",
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{
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"structure_string": "Hf1 Nb2 V1 C4\n1.0\n3.125264 -0.001451 9.956011\n1.524716 2.728097 9.956011\n-0.002474 -0.001451 10.435009\nHf Nb V C\n1 2 1 4\ndirect\n0.003133 0.003134 0.003133 Hf\n0.496872 0.496872 0.496871 Nb\n0.248821 0.248821 0.248820 Nb\n0.751578 0.751579 0.751576 V\n0.873097 0.873098 0.873095 C\n0.624904 0.624905 0.624903 C\n0.380147 0.380147 0.380146 C\n0.121450 0.121450 0.121449 C\n",
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{
"id": "jvasp-119023",
"created_at": "2022-09-04T14:38:32.674893Z",
"updated_at": "2022-09-04T14:38:32.674923Z",
"structure_string": "Fe3 Pb1 S2 O14\n1.0\n5.880092 -0.047955 3.651296\n2.006902 5.527217 3.651296\n-0.069028 -0.047955 6.921176\nFe Pb S O\n3 1 2 14\ndirect\n-0.000000 -0.000000 0.500001 Fe\n0.500000 -0.000000 0.000000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.000000 Pb\n0.691571 0.691570 0.691573 S\n0.308429 0.308428 0.308430 S\n0.265858 0.892414 0.265860 O\n0.107586 0.734141 0.734143 O\n0.734141 0.734141 0.107588 O\n0.734141 0.107585 0.734143 O\n0.517645 0.156244 0.156246 O\n0.156245 0.156244 0.517646 O\n0.843755 0.843755 0.482357 O\n0.482354 0.843755 0.843757 O\n0.265859 0.265858 0.892415 O\n0.843755 0.482354 0.843757 O\n0.391599 0.391599 0.391600 O\n0.608400 0.608400 0.608402 O\n0.156245 0.517645 0.156245 O\n0.892413 0.265858 0.265860 O\n",
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{
"id": "jvasp-119407",
"created_at": "2022-09-04T14:38:32.620168Z",
"updated_at": "2022-09-04T14:38:32.620197Z",
"structure_string": "Ca1 B2 H10 N2\n1.0\n5.009719 0.110219 0.296338\n3.128358 3.914436 0.296338\n0.034065 0.016847 6.305270\nCa B H N\n1 2 10 2\ndirect\n0.448141 0.551859 0.000000 Ca\n0.790020 0.865404 0.216345 B\n0.134596 0.209981 0.783655 B\n0.571960 0.693486 0.423527 H\n0.306515 0.428040 0.576474 H\n0.630778 0.060258 0.682559 H\n0.939743 0.369222 0.317442 H\n0.037052 0.807327 0.305283 H\n0.192673 0.962949 0.694718 H\n0.836361 0.469940 0.742814 H\n0.530061 0.163638 0.257187 H\n0.849511 0.857592 0.020415 H\n0.142408 0.150490 0.979585 H\n0.716369 0.616333 0.284247 N\n0.383667 0.283631 0.715754 N\n",
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{
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"created_at": "2022-09-04T14:38:32.618715Z",
"updated_at": "2022-09-04T14:38:32.618741Z",
"structure_string": "Rb2 Na1 Co1 F6\n1.0\n5.091891 0.000000 2.939805\n1.697296 4.800683 2.939805\n0.000000 0.000000 5.879610\nRb Na Co F\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 Co\n0.774533 0.774532 0.225466 F\n0.774532 0.225467 0.774532 F\n0.225468 0.774532 0.225467 F\n0.774532 0.225467 0.225467 F\n0.225468 0.225467 0.774532 F\n0.225468 0.774532 0.774531 F\n",
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{
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"created_at": "2022-09-04T14:38:39.373971Z",
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"structure_string": "Dy2 B8 Ir4 Rh4\n1.0\n5.369623 -0.000000 0.000000\n0.000000 5.369623 0.000000\n0.000000 -0.000000 7.476848\nDy B Ir Rh\n2 8 4 4\ndirect\n0.500000 0.000000 0.247104 Dy\n-0.000000 0.500000 0.747104 Dy\n-0.000000 0.831659 0.100629 B\n0.831659 0.000000 0.600629 B\n0.168341 0.000000 0.600629 B\n-0.000000 0.168341 0.100629 B\n0.500000 0.328366 0.901977 B\n0.671633 0.500000 0.401977 B\n0.328366 0.500000 0.401977 B\n0.500000 0.671633 0.901977 B\n0.752038 0.500000 0.104105 Ir\n0.247962 0.500000 0.104105 Ir\n0.500000 0.752038 0.604105 Ir\n0.500000 0.247962 0.604105 Ir\n-0.000000 0.749500 0.394737 Rh\n0.749500 0.000000 0.894737 Rh\n0.250499 0.000000 0.894737 Rh\n-0.000000 0.250499 0.394737 Rh\n",
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{
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"created_at": "2022-09-04T14:38:39.467464Z",
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"structure_string": "Ba2 Nb1 Bi1 O6\n1.0\n5.302132 -0.016603 2.988857\n1.738484 5.009048 2.988857\n-0.023415 -0.016603 6.086487\nBa Nb Bi O\n2 1 1 6\ndirect\n0.251329 0.251330 0.251330 Ba\n0.748668 0.748672 0.748672 Ba\n0.499999 0.500001 0.500001 Nb\n0.000000 0.000000 0.000000 Bi\n0.726131 0.212727 0.325737 O\n0.212724 0.325737 0.726133 O\n0.325735 0.726132 0.212727 O\n0.273867 0.787275 0.674265 O\n0.674262 0.273869 0.787275 O\n0.787273 0.674265 0.273869 O\n",
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{
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"created_at": "2022-09-04T14:38:32.597786Z",
"updated_at": "2022-09-04T14:38:32.597806Z",
"structure_string": "Sr2 Li2 Al2 F12\n1.0\n2.552496 -4.421051 -0.000000\n2.552496 4.421051 0.000000\n0.000000 0.000000 10.305641\nSr Li Al F\n2 2 2 12\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.333334 0.666668 0.250000 Li\n0.666668 0.333334 0.750000 Li\n0.666668 0.333334 0.250000 Al\n0.333334 0.666668 0.750000 Al\n0.641554 0.027551 0.351809 F\n0.358448 0.385998 0.851809 F\n0.972451 0.614004 0.351809 F\n0.385997 0.027551 0.148191 F\n0.641554 0.614004 0.148191 F\n0.027551 0.385997 0.648191 F\n0.614004 0.641554 0.648191 F\n0.027551 0.641554 0.851809 F\n0.358448 0.972451 0.648191 F\n0.972451 0.358448 0.148191 F\n0.385998 0.358448 0.351809 F\n0.614004 0.972451 0.851809 F\n",
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{
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"created_at": "2022-09-04T14:38:32.907785Z",
"updated_at": "2022-09-04T14:38:32.907802Z",
"structure_string": "Al3 Cr3 Sb2 O16\n1.0\n5.734118 0.013401 0.008665\n2.843046 4.979784 0.009786\n0.081421 0.044729 9.273125\nAl Cr Sb O\n3 3 2 16\ndirect\n0.165018 0.164961 0.795278 Al\n0.337291 0.832857 0.295935 Al\n0.832758 0.337424 0.295939 Al\n0.166615 0.657498 0.783972 Cr\n0.657570 0.166502 0.783849 Cr\n0.832444 0.832626 0.273487 Cr\n0.330462 0.330630 0.504822 Sb\n0.658153 0.658046 0.012385 Sb\n0.326932 0.834336 0.895960 O\n0.677067 0.677223 0.389628 O\n0.966073 0.526377 0.160678 O\n0.526322 0.966109 0.160652 O\n0.163258 0.163390 0.395447 O\n0.830661 0.830549 0.891432 O\n0.477373 0.042191 0.666334 O\n-0.001671 -0.001750 0.697604 O\n0.671054 0.167682 0.396761 O\n0.001079 0.001175 0.197885 O\n0.522180 0.522264 0.171698 O\n0.333210 0.333016 0.894329 O\n0.481798 0.481724 0.661040 O\n0.167512 0.671228 0.396792 O\n0.042226 0.477322 0.666397 O\n0.834426 0.326812 0.895980 O\n",
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]
}