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{
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"structure_string": "V2 Zn1 O6\n1.0\n3.519480 0.000043 -0.000138\n-1.759629 4.390402 -1.612797\n-0.000294 -0.192724 6.620849\nV Zn O\n2 1 6\ndirect\n0.189192 0.378351 0.652794 V\n0.810808 0.621649 0.347206 V\n0.000000 0.000000 0.000000 Zn\n0.029719 0.059423 0.719655 O\n0.970282 0.940577 0.280344 O\n0.342612 0.685178 0.890047 O\n0.657388 0.314822 0.109952 O\n0.309042 0.618096 0.436409 O\n0.690959 0.381904 0.563590 O\n",
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{
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{
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"structure_string": "Mn6 O4 F8\n1.0\n-4.504529 4.504529 3.078931\n0.236722 4.773722 -3.126489\n-4.773722 -0.236722 -3.126489\nMn O F\n6 4 8\ndirect\n0.836838 0.668563 0.668563 Mn\n0.670829 0.350795 0.350795 Mn\n0.329170 0.649206 0.649206 Mn\n0.163162 0.331437 0.331437 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.371908 0.428141 0.428141 O\n0.040627 0.761687 0.761687 O\n0.628092 0.571860 0.571860 O\n0.959373 0.238314 0.238314 O\n-0.000000 0.302302 0.697698 F\n0.674009 0.028315 0.642570 F\n0.325991 0.357431 0.971685 F\n0.310109 0.879688 0.879688 F\n0.689891 0.120313 0.120313 F\n0.325991 0.971685 0.357431 F\n0.674009 0.642570 0.028315 F\n-0.000000 0.697698 0.302302 F\n",
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"volume": 211.11922003747748,
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"formula_full": "Mn6 O4 F8",
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{
"id": "jvasp-9740",
"created_at": "2022-09-04T14:37:12.853126Z",
"updated_at": "2022-09-04T14:37:12.853156Z",
"structure_string": "Ta4 N4 O4\n1.0\n3.720311 -0.000000 -1.114672\n-0.587966 6.457333 -1.962383\n0.028124 -0.009453 6.859622\nTa N O\n4 4 4\ndirect\n0.602417 0.208052 0.204835 Ta\n0.397581 0.791948 0.795165 Ta\n0.311571 0.194557 0.623143 Ta\n0.688426 0.805443 0.376857 Ta\n0.758666 0.147313 0.517334 N\n0.241332 0.852687 0.482666 N\n0.445928 0.137153 0.891858 N\n0.554070 0.862847 0.108142 N\n0.640546 0.506675 0.281094 O\n0.359452 0.493325 0.718906 O\n0.865366 0.790341 0.730735 O\n0.134632 0.209659 0.269265 O\n",
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{
"id": "jvasp-79670",
"created_at": "2022-09-04T14:37:12.916708Z",
"updated_at": "2022-09-04T14:37:12.916735Z",
"structure_string": "Mn1 V2 Re1\n1.0\n-9.208194 1.643675 -2.632243\n-6.449972 1.142567 0.737145\n-5.700792 3.261567 -0.560472\nMn V Re\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.747222 0.007187 0.007189 V\n0.252776 -0.007187 -0.007187 V\n0.499999 -0.000000 0.000001 Re\n",
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{
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"created_at": "2022-09-04T14:37:12.919284Z",
"updated_at": "2022-09-04T14:37:12.919303Z",
"structure_string": "Mn5 Cu1 O12\n1.0\n2.484550 4.315773 -0.467898\n-2.511905 4.319134 -0.233950\n-0.411288 -0.714425 8.890711\nMn Cu O\n5 1 12\ndirect\n0.166645 0.666708 0.500000 Mn\n0.666663 0.666674 -0.000000 Mn\n0.333336 0.333327 -0.000000 Mn\n0.833354 0.333293 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Cu\n0.963939 0.346742 0.890878 O\n0.382835 -0.000000 0.109132 O\n0.689318 0.346742 0.109121 O\n0.868957 0.666686 0.607826 O\n0.202273 0.000000 0.607846 O\n0.131041 0.333315 0.392174 O\n0.464355 0.666686 0.392174 O\n0.617164 0.000001 0.890867 O\n0.310680 0.653260 0.890878 O\n0.036059 0.653259 0.109122 O\n0.535643 0.333315 0.607826 O\n0.797727 0.000000 0.392154 O\n",
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"formula_full": "Mn5 Cu1 O12",
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{
"id": "jvasp-10308",
"created_at": "2022-09-04T14:37:12.971534Z",
"updated_at": "2022-09-04T14:37:12.971551Z",
"structure_string": "Zn2 Co4 O8\n1.0\n2.785531 -0.000011 0.571413\n1.320780 6.739012 0.637338\n0.000443 0.279372 7.073457\nZn Co O\n2 4 8\ndirect\n0.370199 0.104627 0.155180 Zn\n0.625281 0.872412 0.877047 Zn\n0.637420 0.177199 0.548070 Co\n0.149117 0.498283 0.203564 Co\n0.846346 0.478764 0.828669 Co\n0.358043 0.799854 0.484162 Co\n0.847957 0.680076 0.624100 O\n0.459143 0.327312 0.754504 O\n0.536321 0.649738 0.277726 O\n0.147506 0.296976 0.408133 O\n0.162670 0.004591 0.670134 O\n0.789838 0.338473 0.081964 O\n0.832797 0.972460 0.362097 O\n0.205627 0.638569 0.950269 O\n",
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"spacegroup": 12
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{
"id": "jvasp-79450",
"created_at": "2022-09-04T14:37:17.331943Z",
"updated_at": "2022-09-04T14:37:17.331973Z",
"structure_string": "K1 Mn1 O2\n1.0\n2.826254 -0.001237 0.686312\n1.338913 -3.101024 0.643118\n2.819538 -0.016870 -5.448787\nK Mn O\n1 1 2\ndirect\n0.000003 0.499989 0.500002 K\n-0.000014 0.000024 0.000002 Mn\n0.497706 0.820594 0.183987 O\n0.502293 0.179405 0.816008 O\n",
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{
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"created_at": "2022-09-04T14:37:13.087629Z",
"updated_at": "2022-09-04T14:37:13.087655Z",
"structure_string": "Hg1 C2 S2 N2\n1.0\n3.973256 -0.000332 -0.000016\n-1.987033 5.445417 -0.434872\n0.000029 0.074281 6.383516\nHg C S N\n1 2 2 2\ndirect\n0.002176 0.998920 -0.000555 Hg\n0.740306 0.474940 0.773638 C\n0.264436 0.522900 0.225238 C\n0.873898 0.742522 0.668476 S\n0.130876 0.255321 0.330403 S\n0.643251 0.280609 0.843183 N\n0.361456 0.717231 0.155694 N\n",
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"structure_string": "Y6 O9\n1.0\n3.499220 0.000000 0.000000\n-1.749610 6.886817 -1.245640\n0.000000 0.008076 8.643048\nY O\n6 9\ndirect\n0.635262 0.270525 0.487390 Y\n0.364738 0.729476 0.512611 Y\n0.032920 0.065841 0.813491 Y\n0.690471 0.380943 0.137118 Y\n0.309530 0.619058 0.862882 Y\n0.967081 0.934160 0.186509 Y\n0.127782 0.255564 0.282426 O\n0.825422 0.650845 0.030483 O\n0.793422 0.586844 0.376358 O\n0.471034 0.942067 0.343281 O\n0.528967 0.057934 0.656719 O\n0.500000 0.000000 0.000000 O\n0.174578 0.349156 0.969518 O\n0.206578 0.413157 0.623642 O\n0.872218 0.744437 0.717575 O\n",
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{
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"structure_string": "Be2 Ir1 Rh1\n1.0\n-9.093979 -0.330234 -2.945029\n-6.754007 0.527995 0.017401\n-4.968545 2.442912 -0.703146\nBe Ir Rh\n2 1 1\ndirect\n0.749804 1.000991 -0.002247 Be\n0.250197 -0.000995 1.002251 Be\n0.500001 -0.000003 1.000001 Ir\n1.000001 -0.000004 1.000002 Rh\n",
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{
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"structure_string": "Ba2 Ca1 W1 O6\n1.0\n5.204627 0.010531 2.995500\n1.742231 4.881619 2.987848\n0.028456 0.007706 5.982637\nBa Ca W O\n2 1 1 6\ndirect\n0.250681 0.750218 0.750218 Ba\n0.749319 0.249783 0.249782 Ba\n0.499999 0.999999 0.000001 Ca\n0.000000 0.499999 0.500001 W\n0.752713 0.749197 0.289081 O\n0.247287 0.710919 0.250803 O\n0.247288 0.250805 0.710919 O\n0.752712 0.289080 0.749197 O\n0.191640 0.271130 0.271131 O\n0.808361 0.728870 0.728871 O\n",
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}
]
}