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"id": "jvasp-104169",
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"structure_string": "Li2 Cr2 P2 O8\n1.0\n2.768720 4.040787 0.000000\n-2.768720 4.040787 0.000000\n0.000000 -0.000000 6.408696\nLi Cr P O\n2 2 2 8\ndirect\n0.500000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.207950 0.207950 0.250000 Cr\n0.792051 0.792051 0.750000 Cr\n0.144603 0.144603 0.750000 P\n0.855397 0.855397 0.250000 P\n0.196866 0.740894 0.250000 O\n0.259107 0.803134 0.750000 O\n0.743704 0.743704 0.054623 O\n0.256297 0.256297 0.554624 O\n0.256297 0.256297 0.945377 O\n0.743704 0.743704 0.445377 O\n0.740894 0.196866 0.250000 O\n0.803134 0.259107 0.750000 O\n",
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{
"id": "jvasp-104889",
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"updated_at": "2022-09-04T14:36:58.927037Z",
"structure_string": "La2 Ni1 Mo1 O6\n1.0\n4.852346 -0.000000 2.801503\n1.617449 4.574836 2.801503\n-0.000000 -0.000000 5.603006\nLa Ni Mo O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 La\n0.750001 0.750001 0.749999 La\n0.500000 0.500000 0.499999 Ni\n0.000000 0.000000 0.000000 Mo\n0.752291 0.247710 0.247709 O\n0.247710 0.752291 0.752290 O\n0.247710 0.752291 0.247709 O\n0.752291 0.247710 0.752290 O\n0.247710 0.247710 0.752291 O\n0.752291 0.752291 0.247708 O\n",
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{
"id": "jvasp-43169",
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"structure_string": "Li2 Co1 Sn1 O4\n1.0\n0.000000 5.226168 0.026089\n3.061061 0.000000 0.000000\n0.000000 -1.832365 -5.029727\nLi Co Sn O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.000001 0.500000 0.500000 Li\n0.500001 0.000000 0.500000 Co\n0.500000 0.500000 -0.000000 Sn\n0.745238 0.000000 0.240029 O\n0.727897 0.500000 0.751747 O\n0.254763 0.000000 0.759972 O\n0.272105 0.500000 0.248253 O\n",
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],
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"formula_full": "Li2 Co1 Sn1 O4",
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{
"id": "jvasp-104708",
"created_at": "2022-09-04T14:36:58.121951Z",
"updated_at": "2022-09-04T14:36:58.121983Z",
"structure_string": "Nd1 Mn1 Fe1 Ge2\n1.0\n3.745922 -0.058048 -4.747929\n-0.496329 3.713349 -4.747929\n0.051605 0.058048 6.047487\nNd Mn Fe Ge\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.250000 0.750000 0.500001 Mn\n0.750000 0.250000 0.500000 Fe\n0.626976 0.626976 -0.000001 Ge\n0.373023 0.373023 -0.000000 Ge\n",
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{
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"created_at": "2022-09-04T14:36:58.163684Z",
"updated_at": "2022-09-04T14:36:58.163694Z",
"structure_string": "In1 Ga1 Ag2 Se4\n1.0\n5.523892 0.000161 -4.653176\n-1.195025 5.393079 -4.653176\n-0.000129 -0.000161 7.222563\nIn Ga Ag Se\n1 1 2 4\ndirect\n0.499999 0.500000 -0.000001 In\n0.749999 0.250000 0.499999 Ga\n0.249999 0.750000 0.499999 Ag\n0.000000 0.000000 0.000000 Ag\n0.104811 0.134475 0.501520 Se\n0.632954 0.603291 0.498478 Se\n0.396708 0.895189 0.029662 Se\n0.865524 0.367046 0.970335 Se\n",
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{
"id": "jvasp-103950",
"created_at": "2022-09-04T14:36:58.136253Z",
"updated_at": "2022-09-04T14:36:58.136271Z",
"structure_string": "Hf1 H6 C5 O4\n1.0\n3.472438 -0.011171 0.389889\n1.504844 3.746903 0.588116\n0.052081 -0.000993 8.995598\nHf H C O\n1 6 5 4\ndirect\n0.075810 0.965186 0.328270 Hf\n0.561297 0.098275 0.908667 H\n0.906552 0.301996 0.913474 H\n0.885840 0.577249 0.602463 H\n0.826871 0.170366 0.659219 H\n0.069485 0.655588 0.771267 H\n0.403184 0.877702 0.776177 H\n0.457962 0.491135 0.482844 C\n0.654612 0.455903 0.630399 C\n0.400434 0.458780 0.068231 C\n0.395835 0.613084 0.772633 C\n0.573216 0.361216 0.912547 C\n0.745166 0.566557 0.344936 O\n0.480874 0.143745 0.460646 O\n0.201564 0.774710 0.095683 O\n0.481215 0.198049 0.175168 O\n",
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{
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"created_at": "2022-09-04T14:36:58.147460Z",
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"structure_string": "Al1 Si1 C1 N1\n1.0\n3.105406 -0.000000 0.000000\n-1.552702 2.689361 0.000000\n-0.000000 -0.000000 5.056396\nAl Si C N\n1 1 1 1\ndirect\n0.333334 0.666667 0.506769 Al\n0.666668 0.333333 0.997254 Si\n0.333334 0.666667 0.109163 C\n0.666668 0.333333 0.636816 N\n",
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{
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"updated_at": "2022-09-04T14:36:58.196720Z",
"structure_string": "Li2 Mn1 Fe1 O4\n1.0\n5.026114 -0.220118 0.000000\n2.001757 4.615543 0.000000\n-3.513936 -2.197712 2.851769\nLi Mn Fe O\n2 1 1 4\ndirect\n0.250000 0.750000 0.500000 Li\n0.500000 0.500000 -0.000000 Li\n0.000000 0.000000 0.000000 Mn\n0.749999 0.250000 0.500000 Fe\n0.509720 0.009721 0.500000 O\n0.236488 0.236488 -0.000000 O\n0.990278 0.490279 0.500000 O\n0.763512 0.763512 -0.000000 O\n",
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{
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"structure_string": "Al1 In1 Ag2 Se4\n1.0\n5.511212 -0.007450 -4.615505\n-1.206030 5.377639 -4.615505\n0.005972 0.007450 7.188623\nAl In Ag Se\n1 1 2 4\ndirect\n0.250000 0.750000 0.500000 Al\n0.000000 0.000000 0.000000 In\n0.750000 0.250000 0.500000 Ag\n0.500000 0.500000 0.000001 Ag\n0.601834 0.636706 0.503163 Se\n0.133543 0.098671 0.496838 Se\n0.901329 0.398166 0.034873 Se\n0.363294 0.866457 0.965128 Se\n",
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{
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"created_at": "2022-09-04T14:36:58.532589Z",
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"structure_string": "Cd1 H4 C4 O4\n1.0\n3.551417 -0.113597 0.036432\n-0.367248 4.239989 -0.567799\n0.196468 -0.242186 8.086301\nCd H C O\n1 4 4 4\ndirect\n0.378527 0.679618 0.284364 Cd\n0.525681 0.992377 0.648300 H\n-0.030442 0.920271 0.697601 H\n0.608322 0.539768 0.838596 H\n0.072007 0.881216 0.920018 H\n0.978662 0.222186 0.522089 C\n0.807724 0.116979 0.681593 C\n0.796646 0.356682 0.837609 C\n0.909737 0.307230 0.988991 C\n0.908033 0.027981 0.383299 O\n0.200363 0.476963 0.526597 O\n0.100378 0.059307 0.013897 O\n0.866721 0.500633 0.132697 O\n",
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{
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"structure_string": "Mg2 H12 C10 O8\n1.0\n6.171692 -0.102156 1.107783\n1.164972 6.540657 0.596264\n0.023679 0.244495 7.448251\nMg H C O\n2 12 10 8\ndirect\n0.032485 0.883003 0.570051 Mg\n0.523060 0.808227 0.692154 Mg\n0.084781 0.228348 0.114562 H\n0.399902 0.317278 0.108705 H\n0.797426 0.371748 0.562168 H\n0.619614 0.464381 0.125611 H\n0.547583 0.742664 0.269247 H\n0.348334 0.953507 0.213919 H\n0.003939 0.478371 0.937232 H\n0.227714 0.626089 0.147938 H\n0.823312 0.714993 0.966782 H\n-0.022228 0.784203 0.218401 H\n0.863472 0.266370 0.877816 H\n0.584723 0.995131 0.297893 H\n0.564809 0.350102 0.060047 C\n0.048586 0.636249 0.165681 C\n0.694737 0.244126 -0.069884 C\n0.969866 0.464870 0.301322 C\n0.461018 0.892754 0.311208 C\n0.009001 0.257724 0.256733 C\n-0.009856 0.634334 0.974572 C\n0.616351 0.089696 0.846757 C\n0.862534 0.499849 0.476508 C\n0.275704 0.329966 0.596389 C\n0.828311 0.673792 0.548426 O\n0.348164 0.871700 0.494635 O\n0.432205 0.338176 0.490977 O\n0.425881 0.041277 0.886523 O\n0.130657 0.737178 0.832439 O\n0.753836 -0.005651 0.720414 O\n0.968327 0.103555 0.366113 O\n0.351188 0.601448 0.827357 O\n",
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}
]
}