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{
"id": "jvasp-110021",
"created_at": "2022-09-04T14:38:01.912709Z",
"updated_at": "2022-09-04T14:38:01.912736Z",
"structure_string": "Pr1 Cu1 O3\n1.0\n3.840031 -0.000000 0.000000\n0.000000 3.840031 0.000000\n-0.000000 -0.000000 3.840031\nPr Cu O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n",
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{
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"structure_string": "Cr3 Fe1\n1.0\n2.829387 2.829387 0.000000\n2.829387 -0.000000 -2.829387\n-0.000000 2.829387 -2.829387\nCr Fe\n3 1\ndirect\n0.250000 0.250000 0.250000 Cr\n0.750001 0.750001 0.750001 Cr\n0.500001 0.500001 0.500001 Cr\n0.000000 0.000000 0.000000 Fe\n",
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{
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"structure_string": "Be2 Zn1 Ru1\n1.0\n2.903830 0.000000 -0.000000\n0.000000 2.903830 0.000000\n-0.000000 0.000000 5.372435\nBe Zn Ru\n2 1 1\ndirect\n0.000000 0.000000 0.029320 Be\n0.500000 0.500000 0.250231 Be\n0.500000 0.500000 0.765173 Zn\n0.000000 0.000000 0.455275 Ru\n",
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{
"id": "jvasp-113200",
"created_at": "2022-09-04T14:38:47.451169Z",
"updated_at": "2022-09-04T14:38:47.451177Z",
"structure_string": "Li2 Fe2 P4 O14\n1.0\n8.348879 0.000000 0.000000\n-0.000000 4.280854 1.976298\n-0.000000 0.308808 7.113990\nLi Fe P O\n2 2 4 14\ndirect\n0.515534 0.680416 0.787522 Li\n0.015534 0.319583 0.212478 Li\n0.157874 0.718193 0.727823 Fe\n0.657875 0.281806 0.272177 Fe\n0.812469 0.563233 0.551408 P\n0.208903 0.936460 0.005825 P\n0.708903 0.063540 0.994175 P\n0.312469 0.436767 0.448592 P\n0.473005 0.311759 0.414928 O\n0.174372 0.204626 0.480291 O\n0.831050 0.438982 0.387311 O\n0.056255 0.773567 0.978139 O\n0.271075 0.760972 0.242330 O\n0.771075 0.239028 0.757670 O\n0.973005 0.688241 0.585073 O\n0.331050 0.561017 0.612689 O\n0.674373 0.795373 0.519709 O\n0.832993 0.109680 0.138462 O\n0.332993 0.890319 0.861538 O\n0.673680 0.729778 0.022754 O\n0.556255 0.226432 0.021861 O\n0.173679 0.270221 -0.022754 O\n",
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"volume": 249.16107214926424,
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{
"id": "jvasp-43979",
"created_at": "2022-09-04T14:36:03.723187Z",
"updated_at": "2022-09-04T14:36:03.723215Z",
"structure_string": "Li4 Mn2 F8\n1.0\n3.192518 -0.002047 -0.002628\n0.003446 5.179618 0.031453\n0.009092 1.195983 9.596041\nLi Mn F\n4 2 8\ndirect\n0.000787 0.265815 0.077999 Li\n0.000924 0.230697 0.423040 Li\n0.999849 0.730720 0.923053 Li\n0.999934 0.765827 0.578009 Li\n0.500045 0.248271 0.750524 Mn\n0.500730 0.748260 0.250528 Mn\n0.500795 0.106229 0.131204 F\n0.000074 0.119292 0.621503 F\n0.500934 0.390291 0.369851 F\n0.000703 0.619257 0.121511 F\n0.000035 0.377261 0.879552 F\n0.499924 0.606265 0.631223 F\n0.000725 0.877257 0.379546 F\n0.499841 0.890289 0.869848 F\n",
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{
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"created_at": "2022-09-04T14:36:02.266088Z",
"updated_at": "2022-09-04T14:36:02.266117Z",
"structure_string": "Mn6 O5 F7\n1.0\n4.679394 -0.168743 0.001088\n-0.168743 4.679394 0.001088\n0.001713 0.001713 9.322418\nMn O F\n6 5 7\ndirect\n0.004796 0.995204 0.000000 Mn\n0.977033 0.960478 0.341020 Mn\n0.039521 0.022966 0.658981 Mn\n0.502820 0.491487 0.841966 Mn\n0.508512 0.497179 0.158034 Mn\n0.473340 0.526660 0.500000 Mn\n0.671930 0.682355 0.331319 O\n0.705393 0.688421 0.998704 O\n0.317644 0.328069 0.668682 O\n0.311578 0.294607 0.001296 O\n0.182622 0.817377 0.500000 O\n0.189352 0.788139 0.165715 F\n0.211861 0.810647 0.834286 F\n0.277831 0.282421 0.320272 F\n0.717578 0.722168 0.679728 F\n0.775989 0.224010 0.500000 F\n0.801754 0.169557 0.176653 F\n0.830442 0.198245 0.823347 F\n",
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"formula_full": "Mn6 O5 F7",
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{
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"created_at": "2022-09-04T14:38:44.964013Z",
"updated_at": "2022-09-04T14:38:44.964033Z",
"structure_string": "V4 Sb4 O16\n1.0\n5.608454 0.002932 0.219265\n1.745825 5.329735 0.219277\n-0.010057 -0.007374 9.094797\nV Sb O\n4 4 16\ndirect\n0.495878 0.495881 0.504130 V\n0.870884 0.870876 0.629121 V\n0.995877 0.995879 0.004129 V\n0.370883 0.370875 0.129120 V\n0.752033 0.752028 0.247968 Sb\n0.252034 0.252029 0.747967 Sb\n0.627032 0.627034 0.872967 Sb\n0.127033 0.127034 0.372966 Sb\n0.432680 0.815867 0.375739 O\n0.932678 0.315864 0.875737 O\n0.315850 0.932662 0.875727 O\n0.815853 0.432663 0.375729 O\n0.095052 0.095085 0.596525 O\n0.595050 0.595083 0.096526 O\n0.350901 0.350899 0.347354 O\n0.678526 0.075031 0.123222 O\n0.575034 0.178528 0.623227 O\n0.075032 0.678527 0.123225 O\n0.403478 0.403463 0.904934 O\n0.178528 0.575034 0.623223 O\n0.152646 0.152650 0.149097 O\n0.652647 0.652653 0.649098 O\n0.850899 0.850898 0.847355 O\n0.903480 0.903464 0.404934 O\n",
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"volume": 271.8292318609745,
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"formula_full": "V4 Sb4 O16",
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{
"id": "jvasp-98484",
"created_at": "2022-09-04T14:36:01.755751Z",
"updated_at": "2022-09-04T14:36:01.755775Z",
"structure_string": "Tb4 Mn4 O12\n1.0\n5.286690 -0.000000 0.000000\n-0.000000 5.647393 0.000000\n0.000000 0.000000 7.587418\nTb Mn O\n4 4 12\ndirect\n0.981541 0.072210 0.250001 Tb\n0.518458 0.572210 0.250001 Tb\n0.018457 0.927789 0.750001 Tb\n0.481541 0.427789 0.750001 Tb\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.395210 0.967506 0.250001 O\n0.895211 0.532494 0.750001 O\n0.696910 0.306513 0.446672 O\n0.696910 0.306513 0.053328 O\n0.196910 0.193487 0.946672 O\n0.803091 0.806513 0.446672 O\n0.303090 0.693486 0.553328 O\n0.303090 0.693486 0.946672 O\n0.803091 0.806513 0.053328 O\n0.196910 0.193487 0.553328 O\n0.104790 0.467506 0.250001 O\n0.604790 0.032494 0.750001 O\n",
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"formula_full": "Tb4 Mn4 O12",
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{
"id": "jvasp-117407",
"created_at": "2022-09-04T14:38:26.496975Z",
"updated_at": "2022-09-04T14:38:26.496999Z",
"structure_string": "Tb4 Mn4 O12\n1.0\n5.287070 -0.000000 0.000000\n0.000000 5.647264 0.000000\n-0.000000 -0.000000 7.587292\nTb Mn O\n4 4 12\ndirect\n0.518449 0.572173 0.250000 Tb\n0.981551 0.072173 0.250000 Tb\n0.481551 0.427827 0.750000 Tb\n0.018449 0.927826 0.750000 Tb\n-0.000000 0.500000 -0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n-0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 -0.000000 Mn\n0.303098 0.693500 0.553326 O\n0.196902 0.193500 0.946673 O\n0.303098 0.693500 0.946673 O\n0.196902 0.193500 0.553326 O\n0.696902 0.306499 0.446674 O\n0.104784 0.467521 0.250000 O\n0.895216 0.532479 0.750000 O\n0.604784 0.032479 0.750000 O\n0.803098 0.806499 0.446674 O\n0.395216 0.967520 0.250000 O\n0.803098 0.806499 0.053326 O\n0.696902 0.306499 0.053326 O\n",
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{
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"structure_string": "Cr3 Fe1\n1.0\n3.481121 0.000000 -0.000000\n0.000000 3.481121 -0.000000\n-1.740561 -1.740561 3.738826\nCr Fe\n3 1\ndirect\n0.500000 0.500000 0.000000 Cr\n0.250000 0.750000 0.500001 Cr\n0.750000 0.250000 0.500001 Cr\n0.000000 0.000000 0.000000 Fe\n",
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{
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"structure_string": "Cr3 Fe1\n1.0\n3.482003 0.000000 -0.000000\n0.000000 3.482003 -0.000000\n-1.741002 -1.741002 3.737046\nCr Fe\n3 1\ndirect\n0.500000 0.500000 0.000000 Cr\n0.250000 0.750000 0.500000 Cr\n0.750000 0.250000 0.500000 Cr\n0.000000 0.000000 0.000000 Fe\n",
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{
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}