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{
"id": "jvasp-115090",
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"structure_string": "Al1 Ga1 O2\n1.0\n1.475848 0.852081 6.591570\n-1.475848 0.852081 6.591570\n0.000000 -1.704163 6.591570\nAl Ga O\n1 1 2\ndirect\n0.179399 0.179399 0.179399 Al\n0.997938 0.997938 0.997938 Ga\n0.270656 0.270656 0.270656 O\n0.711008 0.711008 0.711008 O\n",
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{
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"structure_string": "Li1 Cr4 In1 S8\n1.0\n6.211893 0.020735 3.847529\n2.152924 5.826917 3.847529\n0.029660 0.020735 7.306861\nLi Cr In S\n1 4 1 8\ndirect\n0.369611 0.369611 0.369612 Li\n0.490236 0.002944 0.002944 Cr\n0.002944 0.002944 0.490236 Cr\n0.002944 0.490236 0.002944 Cr\n0.627404 0.627403 0.627405 Cr\n0.005085 0.005085 0.005085 In\n0.230907 0.745821 0.745822 S\n0.745821 0.745821 0.230909 S\n0.745821 0.230907 0.745822 S\n0.758527 0.758527 0.758529 S\n0.770746 0.256545 0.256546 S\n0.256546 0.256545 0.770747 S\n0.256545 0.770746 0.256546 S\n0.236860 0.236860 0.236861 S\n",
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{
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"updated_at": "2022-09-04T14:38:44.972946Z",
"structure_string": "Cd1 H4 C4 O4\n1.0\n3.790880 0.006821 0.048840\n0.377659 4.247213 0.730990\n0.106246 0.423089 7.854640\nCd H C O\n1 4 4 4\ndirect\n0.385836 0.655452 0.249412 Cd\n0.659404 0.074571 0.670334 H\n0.099819 -0.000305 0.741005 H\n0.585448 0.547308 0.816076 H\n0.031383 0.472970 0.881737 H\n0.013790 0.404695 0.538432 C\n0.885401 0.190549 0.702988 C\n0.800884 0.359314 0.852371 C\n0.700127 0.132463 0.018013 C\n0.919456 0.359925 0.389733 O\n0.231593 0.607489 0.546271 O\n0.849930 0.848513 0.055602 O\n0.449635 0.214440 0.116310 O\n",
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{
"id": "jvasp-120527",
"created_at": "2022-09-04T14:38:44.972279Z",
"updated_at": "2022-09-04T14:38:44.972304Z",
"structure_string": "K1 Nb4 Ag1 P2 S20\n1.0\n6.862990 -0.085378 1.683178\n0.072566 7.130391 0.051369\n-0.046977 -0.004076 13.067677\nK Nb Ag P S\n1 4 1 2 20\ndirect\n0.575119 0.497952 0.418166 K\n0.003989 0.070075 0.894425 Nb\n0.994831 0.935452 0.105596 Nb\n0.003292 0.064548 0.605987 Nb\n0.996505 0.930385 0.396955 Nb\n0.506581 0.501605 0.996532 Ag\n0.789052 0.394866 0.774447 P\n0.207472 0.607340 0.222090 P\n0.452156 0.450371 0.190520 S\n0.958209 0.430937 0.882423 S\n0.034736 0.573017 0.116874 S\n0.282460 0.903913 0.480957 S\n0.232072 0.172286 0.434630 S\n0.715779 0.086009 0.523676 S\n0.544574 0.549798 0.803722 S\n0.768927 0.816763 0.567919 S\n0.221814 0.184380 0.008952 S\n0.287445 0.917840 0.951599 S\n0.869553 0.150209 0.268761 S\n0.132683 0.852165 0.735452 S\n0.953609 0.427357 0.621653 S\n0.711615 0.088034 0.049392 S\n0.260834 0.897147 0.217213 S\n0.738209 0.103266 0.783382 S\n0.737473 0.889593 0.283117 S\n0.260592 0.115215 0.716829 S\n0.776559 0.821597 0.991524 S\n0.052459 0.567667 0.376914 S\n",
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{
"id": "jvasp-112860",
"created_at": "2022-09-04T14:38:44.967265Z",
"updated_at": "2022-09-04T14:38:44.967292Z",
"structure_string": "Zn2 Si4 Sn2 O12\n1.0\n6.627786 0.093817 1.602487\n0.173352 6.626183 1.602487\n-0.187077 -0.184846 5.381717\nZn Si Sn O\n2 4 2 12\ndirect\n0.602398 0.397602 0.250001 Zn\n0.397602 0.602397 0.750001 Zn\n0.871317 0.690901 0.776314 Si\n0.309099 0.128683 0.723689 Si\n0.690901 0.871317 0.276313 Si\n0.128683 0.309099 0.223688 Si\n0.786358 0.213641 0.750001 Sn\n0.213641 0.786358 0.250001 Sn\n0.898943 0.390137 0.307905 O\n0.609863 0.101057 0.192097 O\n0.522078 0.699240 0.358545 O\n0.300759 0.477922 0.141456 O\n0.477922 0.300759 0.641457 O\n0.149893 0.187374 0.981352 O\n0.850107 0.812626 0.018651 O\n0.187374 0.149893 0.481351 O\n0.101057 0.609862 0.692097 O\n0.812626 0.850106 0.518651 O\n0.699241 0.522077 0.858546 O\n0.390137 0.898942 0.807905 O\n",
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"formula_full": "Zn2 Si4 Sn2 O12",
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{
"id": "jvasp-112138",
"created_at": "2022-09-04T14:38:44.966254Z",
"updated_at": "2022-09-04T14:38:44.966280Z",
"structure_string": "Zn1 H18 C11 O4\n1.0\n4.401702 0.022215 0.796034\n-2.295212 4.335555 -1.082941\n0.111321 -0.235885 14.188396\nZn H C O\n1 18 11 4\ndirect\n0.157405 0.228545 0.160638 Zn\n0.067954 0.019081 0.539938 H\n0.601104 0.561661 0.449759 H\n0.010918 0.238168 0.925277 H\n0.129066 0.162898 0.697790 H\n0.903042 0.867711 0.768332 H\n0.780819 0.512624 0.605260 H\n0.106478 0.426405 0.538839 H\n0.376852 0.914270 0.471948 H\n0.209131 0.543412 0.858032 H\n0.727052 0.791830 0.947198 H\n0.582318 0.458537 0.001129 H\n0.655453 0.360466 0.783141 H\n0.445490 0.057394 0.851617 H\n0.546513 0.937990 0.631489 H\n0.294711 0.638030 0.699343 H\n0.955395 0.082066 0.386257 H\n0.205183 0.926443 0.309932 H\n0.901435 0.446022 0.381178 H\n0.302062 0.716984 0.056012 C\n0.499092 0.597988 0.974210 C\n0.260246 0.395763 0.892451 C\n0.402258 0.206639 0.815594 C\n0.160662 0.010029 0.735202 C\n0.870416 0.649041 0.419775 C\n0.052981 0.618603 0.576603 C\n0.106726 0.818500 0.502453 C\n0.947261 0.861700 0.347739 C\n0.699884 0.736416 0.270319 C\n0.281859 0.799203 0.661125 C\n0.092231 0.539223 0.115398 O\n0.726829 0.911398 0.213152 O\n0.463217 0.458926 0.266732 O\n0.336523 -0.014047 0.057340 O\n",
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{
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"updated_at": "2022-09-04T14:38:44.964916Z",
"structure_string": "In1 I3\n1.0\n6.120678 0.000000 -0.000000\n-3.060339 5.300662 -0.000000\n0.000000 0.000000 6.037620\nIn I\n1 3\ndirect\n0.666667 0.333333 0.000000 In\n0.333334 0.666666 0.745652 I\n0.000000 0.000000 0.000000 I\n0.333334 0.666666 0.254348 I\n",
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{
"id": "jvasp-113178",
"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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{
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"structure_string": "In1 I2\n1.0\n6.203893 1.971459 0.864320\n-2.292342 -4.153381 -0.127007\n0.896687 -0.320418 -5.705427\nIn I\n1 2\ndirect\n0.026878 0.081008 0.995528 In\n0.027618 0.204707 0.495546 I\n0.527154 0.151366 0.995601 I\n",
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{
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"created_at": "2022-09-04T14:38:44.957908Z",
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"structure_string": "Tb10 Ga6\n1.0\n6.893860 0.071138 -5.636243\n-1.505781 6.727778 -5.636243\n-0.056377 -0.071138 8.904458\nTb Ga\n10 6\ndirect\n0.500000 0.500000 0.000001 Tb\n0.000000 0.000000 0.000000 Tb\n0.521880 0.021880 0.840871 Tb\n0.181009 0.681009 0.159129 Tb\n0.021880 0.181009 0.500000 Tb\n0.681009 0.521880 0.500001 Tb\n0.478120 0.978120 0.159130 Tb\n0.818991 0.318991 0.840872 Tb\n0.978120 0.818992 0.500001 Tb\n0.318991 0.478120 0.500000 Tb\n0.250000 0.250000 0.000000 Ga\n0.750000 0.750000 0.000001 Ga\n0.878318 0.378318 0.256635 Ga\n0.121682 0.621682 0.743366 Ga\n0.378318 0.121682 0.500000 Ga\n0.621682 0.878318 0.500001 Ga\n",
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{
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"structure_string": "Hf1 Ga3 Ni12\n1.0\n3.626417 0.000000 0.000000\n0.000000 3.626417 0.000000\n-0.000000 -0.000000 14.246987\nHf Ga Ni\n1 3 12\ndirect\n0.000000 0.000000 0.000000 Hf\n0.000000 0.000000 0.256332 Ga\n0.000000 0.000000 0.500000 Ga\n0.000000 0.000000 0.743669 Ga\n0.500000 0.500000 -0.000000 Ni\n0.500000 0.500000 0.255023 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.500000 0.744978 Ni\n0.500000 0.000000 0.133086 Ni\n0.500000 0.000000 0.377374 Ni\n0.500000 0.000000 0.622626 Ni\n0.500000 0.000000 0.866914 Ni\n-0.000000 0.500000 0.133086 Ni\n-0.000000 0.500000 0.377374 Ni\n-0.000000 0.500000 0.622626 Ni\n-0.000000 0.500000 0.866914 Ni\n",
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{
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"structure_string": "Li1 As1 O1\n1.0\n3.084976 0.000000 0.000000\n0.000000 3.084976 -0.000000\n-0.000000 -0.000000 5.797767\nLi As O\n1 1 1\ndirect\n0.000000 0.000000 0.711892 Li\n0.000000 0.000000 0.293407 As\n0.000000 0.000000 -0.000028 O\n",
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}
]
}