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{
"id": "jvasp-88690",
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"structure_string": "Sb4 Cl12 F8\n1.0\n6.528304 -0.000000 2.624140\n3.264153 9.094344 1.312071\n-0.127680 0.000000 9.750231\nSb Cl F\n4 12 8\ndirect\n0.212368 0.820961 0.726824 Sb\n0.939192 0.273176 0.820961 Sb\n0.760153 0.179039 0.273176 Sb\n0.033331 0.726824 0.179039 Sb\n0.675317 0.100043 0.515622 Cl\n0.503089 0.846122 0.769137 Cl\n0.118348 0.153878 0.230863 Cl\n0.272226 0.230863 0.846122 Cl\n0.775359 0.515622 0.899957 Cl\n0.190940 0.484378 0.100043 Cl\n0.346825 0.567216 0.695113 Cl\n0.914041 0.695113 0.432784 Cl\n0.349211 0.769136 0.153878 Cl\n0.609155 0.432783 0.304887 Cl\n0.041939 0.304887 0.567216 Cl\n0.290981 0.899957 0.484378 Cl\n0.673574 0.250258 0.836759 F\n0.886492 0.956880 0.203726 F\n0.760592 0.749741 0.163241 F\n0.510334 0.163241 0.250259 F\n0.923832 0.836759 0.749742 F\n0.090218 0.796274 0.956881 F\n0.843372 0.203726 0.043120 F\n0.047099 0.043119 0.796274 F\n",
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{
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{
"id": "jvasp-3177",
"created_at": "2022-09-04T14:35:51.020554Z",
"updated_at": "2022-09-04T14:35:51.020581Z",
"structure_string": "Mg1 Be2 N2\n1.0\n1.477014 -2.558264 0.000000\n1.477014 2.558264 0.000000\n0.000000 0.000000 5.088482\nMg Be N\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.666665 0.333332 0.371569 Be\n0.333332 0.666665 0.628430 Be\n0.666665 0.333332 0.722605 N\n0.333332 0.666665 0.277395 N\n",
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{
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"updated_at": "2022-09-04T14:37:59.634126Z",
"structure_string": "As8 Cl12 O4 F20\n1.0\n0.000000 5.830150 -0.060938\n18.399294 0.000000 0.000000\n0.000000 -2.287563 -7.460645\nAs Cl O F\n8 12 4 20\ndirect\n0.560072 0.620780 0.169722 As\n0.145168 0.611142 0.797159 As\n0.560072 0.879219 0.669722 As\n0.439929 0.379220 0.830279 As\n0.854833 0.388858 0.202842 As\n0.439929 0.120780 0.330279 As\n0.854833 0.111142 0.702842 As\n0.145168 0.888858 0.297158 As\n0.670896 0.134782 0.893675 Cl\n0.329105 0.634782 0.606326 Cl\n0.882546 0.531952 0.694270 Cl\n0.882546 0.968047 0.194269 Cl\n0.028244 0.207599 0.663986 Cl\n0.117455 0.031952 0.805731 Cl\n0.028244 0.292401 0.163986 Cl\n0.971756 0.792401 0.336015 Cl\n0.329105 0.865218 0.106326 Cl\n0.971757 0.707599 0.836015 Cl\n0.670896 0.365218 0.393675 Cl\n0.117455 0.468047 0.305731 Cl\n0.673487 0.072076 0.513995 O\n0.673487 0.427924 0.013994 O\n0.326513 0.927924 0.486006 O\n0.326513 0.572076 -0.013994 O\n0.431292 0.039293 0.207784 F\n0.326293 0.844985 0.749817 F\n0.214352 0.412197 0.919680 F\n0.225950 0.339686 0.646848 F\n0.214352 0.087803 0.419680 F\n0.462060 0.300247 0.965323 F\n0.774051 0.660314 0.353153 F\n0.774051 0.839686 0.853153 F\n0.568709 0.960707 0.792217 F\n0.462059 0.199753 0.465323 F\n0.326293 0.655015 0.249817 F\n0.537941 0.800247 0.534678 F\n0.431293 0.460707 0.707784 F\n0.568708 0.539293 0.292217 F\n0.785649 0.912197 0.580321 F\n0.673708 0.155015 0.250184 F\n0.537941 0.699753 0.034677 F\n0.673708 0.344985 0.750184 F\n0.785649 0.587803 0.080321 F\n0.225949 0.160314 0.146848 F\n",
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{
"id": "jvasp-11052",
"created_at": "2022-09-04T14:37:34.696828Z",
"updated_at": "2022-09-04T14:37:34.696859Z",
"structure_string": "Ca1 Mn2 F10\n1.0\n5.053650 0.056367 -1.984187\n-2.035547 4.990701 -0.654987\n-0.269807 -0.056165 7.455273\nCa Mn F\n1 2 10\ndirect\n0.288789 0.538789 0.749999 Ca\n-0.000338 0.008406 0.007797 Mn\n0.500608 0.991865 0.492202 Mn\n0.331021 0.081022 0.250000 F\n0.669566 0.919567 0.749999 F\n0.549110 0.724334 0.374308 F\n0.850024 0.174803 0.125691 F\n0.786703 0.692707 0.022292 F\n0.170413 0.764411 0.477707 F\n0.186182 0.316504 0.965277 F\n0.851226 0.220905 0.534721 F\n0.150369 0.836251 0.876102 F\n0.460148 0.274266 0.623896 F\n",
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{
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"created_at": "2022-09-04T14:38:33.442372Z",
"updated_at": "2022-09-04T14:38:33.442385Z",
"structure_string": "K6 Bi2\n1.0\n3.072973 -5.322546 -0.000000\n3.072973 5.322546 0.000000\n-0.000000 0.000000 10.903472\nK Bi\n6 2\ndirect\n0.666667 0.333332 0.918140 K\n0.333332 0.666667 0.418140 K\n0.000000 0.000000 0.250000 K\n0.333332 0.666667 0.081860 K\n0.000000 0.000000 0.750000 K\n0.666667 0.333332 0.581859 K\n0.333332 0.666667 0.750000 Bi\n0.666667 0.333332 0.250000 Bi\n",
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{
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"updated_at": "2022-09-04T14:38:42.363276Z",
"structure_string": "Ca1 Zr1 O1\n1.0\n3.305944 0.000000 0.000000\n-0.000000 3.305944 -0.000000\n0.000000 -0.000000 7.366487\nCa Zr O\n1 1 1\ndirect\n0.000000 0.000000 0.018491 Ca\n0.000000 0.000000 0.551733 Zr\n0.000000 0.000000 0.300884 O\n",
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{
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"created_at": "2022-09-04T14:38:14.323620Z",
"updated_at": "2022-09-04T14:38:14.323643Z",
"structure_string": "Sr1 Ca1 Si4\n1.0\n4.180989 -0.009893 -6.239380\n-0.394754 4.162323 -6.239380\n0.009020 0.009893 7.510689\nSr Ca Si\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250001 0.749999 0.500000 Ca\n0.666254 0.166251 0.500000 Si\n0.586114 0.586113 0.000001 Si\n0.833750 0.333747 0.500001 Si\n0.413888 0.413887 0.000000 Si\n",
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{
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"created_at": "2022-09-04T14:38:11.916877Z",
"updated_at": "2022-09-04T14:38:11.916904Z",
"structure_string": "K2 Sm1 Cu1 Cl6\n1.0\n6.328170 -0.000000 3.653571\n2.109390 5.966256 3.653571\n-0.000000 -0.000000 7.307142\nK Sm Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Cu\n0.741840 0.258160 0.258160 Cl\n0.258160 0.258160 0.741839 Cl\n0.258160 0.741840 0.741839 Cl\n0.258160 0.741840 0.258160 Cl\n0.741840 0.258160 0.741839 Cl\n0.741840 0.741840 0.258160 Cl\n",
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{
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{
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"formula_full": "Na4 Co4 P4 O16",
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"spacegroup": 14
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{
"id": "jvasp-31892",
"created_at": "2022-09-04T14:37:59.014536Z",
"updated_at": "2022-09-04T14:37:59.014564Z",
"structure_string": "Mo2 Cl10\n1.0\n6.028434 -0.010533 -0.064272\n-2.928274 5.499840 -2.082154\n0.031870 0.005100 9.011038\nMo Cl\n2 10\ndirect\n0.106652 0.718415 0.719848 Mo\n0.893348 0.281585 0.280153 Mo\n0.248749 0.689148 0.454621 Cl\n0.122199 0.117461 0.351214 Cl\n0.751252 0.310852 0.545380 Cl\n0.450069 0.082882 0.839051 Cl\n0.877801 0.882540 0.648787 Cl\n0.549931 0.917119 0.160950 Cl\n0.072710 0.312485 0.063221 Cl\n0.308769 0.503159 0.743853 Cl\n0.691232 0.496842 0.256148 Cl\n0.927290 0.687516 0.936780 Cl\n",
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"formula_full": "Mo2 Cl10",
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}
]
}