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{
"id": "jvasp-108734",
"created_at": "2022-09-04T14:38:19.160571Z",
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{
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{
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"structure_string": "Pb8 C4 Br8 O12\n1.0\n8.381912 0.000000 0.000000\n0.000000 8.381912 -0.000000\n-0.000000 -0.000000 9.134068\nPb C Br O\n8 4 8 12\ndirect\n0.161142 0.661142 0.252295 Pb\n0.338858 0.161142 0.252295 Pb\n0.661142 0.838858 0.252295 Pb\n0.661142 0.838858 0.747705 Pb\n0.338858 0.161142 0.747705 Pb\n0.838858 0.338858 0.252295 Pb\n0.161142 0.661142 0.747705 Pb\n0.838858 0.338858 0.747705 Pb\n0.674820 0.174820 0.000000 C\n0.825180 0.674820 0.000000 C\n0.174820 0.325180 0.000000 C\n0.325180 0.825180 0.000000 C\n0.849963 0.650037 0.500000 Br\n0.650037 0.150037 0.500000 Br\n0.349963 0.849963 0.500000 Br\n0.500000 0.500000 0.232992 Br\n0.000000 0.000000 0.767008 Br\n0.500000 0.500000 0.767008 Br\n0.000000 0.000000 0.232992 Br\n0.150037 0.349963 0.500000 Br\n0.625343 0.125343 0.125675 O\n0.125343 0.374657 0.874326 O\n0.874657 0.625343 0.874326 O\n0.874657 0.625343 0.125675 O\n0.125343 0.374657 0.125675 O\n0.714193 0.785807 0.000000 O\n0.785807 0.285807 0.000000 O\n0.285807 0.214193 0.000000 O\n0.214193 0.714193 0.000000 O\n0.374657 0.874657 0.874326 O\n0.374657 0.874657 0.125675 O\n0.625343 0.125343 0.874326 O\n",
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{
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"structure_string": "Sr8 Sn4 S12 F8\n1.0\n5.966276 -0.000000 0.000000\n-0.000000 5.951323 0.000000\n0.000000 0.000000 19.008294\nSr Sn S F\n8 4 12 8\ndirect\n0.246771 0.497318 0.073877 Sr\n0.746771 0.002682 0.426123 Sr\n0.253229 0.997318 0.926123 Sr\n0.753230 0.502681 0.573877 Sr\n0.246771 0.497318 0.426123 Sr\n0.746771 0.002682 0.073877 Sr\n0.253229 0.997318 0.573877 Sr\n0.753230 0.502681 0.926123 Sr\n0.156958 0.568996 0.750000 Sn\n0.656958 0.931003 0.750000 Sn\n0.843043 0.431003 0.250000 Sn\n0.343042 0.068996 0.250000 Sn\n0.744585 0.519026 0.750000 S\n0.257200 0.487743 0.631746 S\n0.757200 0.012256 0.868253 S\n0.242801 0.987743 0.368253 S\n0.742801 0.512256 0.131746 S\n0.244585 0.980973 0.750000 S\n0.257200 0.487743 0.868253 S\n0.255416 0.480973 0.250000 S\n0.757200 0.012256 0.631746 S\n0.242801 0.987743 0.131746 S\n0.742801 0.512256 0.368253 S\n0.755416 0.019027 0.250000 S\n0.000789 0.752529 0.499661 F\n0.500789 0.747470 0.499661 F\n0.000789 0.752529 0.000338 F\n0.999212 0.247470 0.500338 F\n0.499212 0.252530 0.999661 F\n0.499212 0.252530 0.500338 F\n0.999212 0.247470 0.999661 F\n0.500789 0.747470 0.000338 F\n",
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{
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"created_at": "2022-09-04T14:38:11.260518Z",
"updated_at": "2022-09-04T14:38:11.260546Z",
"structure_string": "Ca4 Zn4 Cu2 P6\n1.0\n2.026239 -3.509547 0.000000\n2.026239 3.509547 -0.000000\n0.000000 0.000000 21.427027\nCa Zn Cu P\n4 4 2 6\ndirect\n0.000000 0.000000 0.658923 Ca\n0.000000 0.000000 0.341077 Ca\n0.000000 0.000000 0.158923 Ca\n0.000000 0.000000 0.841077 Ca\n0.333333 0.666667 0.956847 Zn\n0.666667 0.333333 0.456847 Zn\n0.666667 0.333333 0.043153 Zn\n0.333333 0.666667 0.543153 Zn\n0.666667 0.333333 0.750000 Cu\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.576332 P\n0.333333 0.666667 0.423669 P\n0.333333 0.666667 0.750000 P\n0.666667 0.333333 0.923669 P\n0.333333 0.666667 0.076331 P\n0.666667 0.333333 0.250000 P\n",
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{
"id": "jvasp-42751",
"created_at": "2022-09-04T14:36:22.517441Z",
"updated_at": "2022-09-04T14:36:22.517465Z",
"structure_string": "Li2 Co4 O4 F6\n1.0\n3.640392 0.000000 0.000000\n-1.820196 4.789608 0.000000\n-0.000000 0.000000 10.264304\nLi Co O F\n2 4 4 6\ndirect\n0.170087 0.340174 0.250000 Li\n0.829912 0.659826 0.750000 Li\n0.151978 0.303957 0.556704 Co\n0.151978 0.303957 0.943295 Co\n0.848021 0.696044 0.056705 Co\n0.848021 0.696044 0.443295 Co\n0.316548 0.633098 0.458685 O\n0.316548 0.633098 0.041315 O\n0.683451 0.366903 0.958685 O\n0.683451 0.366903 0.541314 O\n0.035272 0.070544 0.119781 F\n0.035272 0.070544 0.380219 F\n0.241208 0.482418 0.750000 F\n0.758791 0.517583 0.250000 F\n0.964727 0.929456 0.619781 F\n0.964727 0.929456 0.880218 F\n",
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"created_at": "2022-09-04T14:37:11.167887Z",
"updated_at": "2022-09-04T14:37:11.167905Z",
"structure_string": "Yb2 U1 S3 O2\n1.0\n3.708869 -0.001576 -9.877544\n-0.123726 3.706805 -9.877544\n0.001525 0.001576 10.550904\nYb U S O\n2 1 3 2\ndirect\n0.495022 0.495022 -0.000001 Yb\n0.812789 0.812788 -0.000002 Yb\n0.188626 0.188626 -0.000000 U\n0.628163 0.628162 -0.000001 S\n0.363398 0.363398 -0.000001 S\n0.033449 0.033449 -0.000000 S\n0.739275 0.239274 0.500000 O\n0.239274 0.739274 0.500000 O\n",
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{
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"updated_at": "2022-09-04T14:37:07.706721Z",
"structure_string": "V1 Cu3 Se2 S2\n1.0\n5.504726 -0.039235 0.000000\n-0.149407 5.502837 0.000000\n0.000000 0.000000 5.496919\nV Cu Se S\n1 3 2 2\ndirect\n0.000000 0.000000 0.000425 V\n0.500000 0.000000 0.011215 Cu\n-0.000000 0.500000 0.011215 Cu\n0.000000 0.000000 0.494073 Cu\n0.745504 0.745505 0.754313 Se\n0.254496 0.254497 0.754313 Se\n0.229048 0.770952 0.237223 S\n0.770952 0.229049 0.237223 S\n",
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{
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"created_at": "2022-09-04T14:36:02.109313Z",
"updated_at": "2022-09-04T14:36:02.109344Z",
"structure_string": "Rb2 C4 I6 N4\n1.0\n4.335466 -0.000000 0.000000\n0.000000 6.700739 0.000000\n0.000000 0.000000 16.116922\nRb C I N\n2 4 6 4\ndirect\n0.144678 0.250000 0.750000 Rb\n0.855323 0.750000 0.250000 Rb\n0.290500 0.750000 0.048110 C\n0.290500 0.750000 0.451890 C\n0.709501 0.250000 0.951890 C\n0.709501 0.250000 0.548110 C\n0.890427 0.250000 0.429457 I\n0.229408 0.250000 0.250000 I\n0.109574 0.750000 0.570543 I\n0.109574 0.750000 0.929457 I\n0.890427 0.250000 0.070543 I\n0.770593 0.750000 0.750000 I\n0.383294 0.750000 0.116244 N\n0.616706 0.250000 0.883756 N\n0.383294 0.750000 0.383756 N\n0.616706 0.250000 0.616244 N\n",
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{
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"created_at": "2022-09-04T14:35:45.438958Z",
"updated_at": "2022-09-04T14:35:45.438983Z",
"structure_string": "Li2 Fe4 O4 F6\n1.0\n-3.686487 -0.002032 0.001952\n1.840742 4.826377 0.098987\n-0.006012 -0.334184 -10.526995\nLi Fe O F\n2 4 4 6\ndirect\n0.858581 0.722256 0.952522 Li\n0.138066 0.281205 0.047645 Li\n0.863290 0.731697 0.534341 Fe\n0.828516 0.662119 0.242051 Fe\n0.168134 0.341363 0.758118 Fe\n0.133350 0.271801 0.465830 Fe\n0.967319 0.939730 0.374129 O\n0.311758 0.628633 0.561290 O\n0.684882 0.374856 0.438884 O\n0.029325 0.063760 0.626041 O\n0.962631 0.930362 0.117511 F\n0.299174 0.603439 0.913222 F\n0.735805 0.476694 0.737769 F\n0.260843 0.526785 0.262406 F\n0.697468 0.400020 0.086955 F\n0.034023 0.073104 0.882651 F\n",
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{
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"updated_at": "2022-09-04T14:38:27.507206Z",
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}