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{
"id": "jvasp-109926",
"created_at": "2022-09-04T14:38:11.881911Z",
"updated_at": "2022-09-04T14:38:11.881921Z",
"structure_string": "Ba6 Ca2\n1.0\n8.512294 0.000000 0.000000\n-4.256147 7.371863 0.000000\n-0.000000 -0.000000 6.976221\nBa Ca\n6 2\ndirect\n0.168360 0.336719 0.250000 Ba\n0.663280 0.831640 0.250000 Ba\n0.168360 0.831640 0.250000 Ba\n0.831639 0.663281 0.750000 Ba\n0.336719 0.168360 0.750000 Ba\n0.831639 0.168360 0.750000 Ba\n0.333333 0.666666 0.750000 Ca\n0.666666 0.333333 0.250000 Ca\n",
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{
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{
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{
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"updated_at": "2022-09-04T14:38:11.892449Z",
"structure_string": "Li4 Si4 Ni2 O12\n1.0\n2.890643 4.821822 0.097187\n-2.890643 4.821822 -0.097187\n-0.275950 0.000000 9.093854\nLi Si Ni O\n4 4 2 12\ndirect\n0.613307 0.716759 0.882677 Li\n0.283241 0.386693 0.382678 Li\n0.716759 0.613307 0.617322 Li\n0.386693 0.283241 0.117322 Li\n0.135849 0.793202 0.636557 Si\n0.206798 0.864150 0.136557 Si\n0.793202 0.135849 0.863443 Si\n0.864150 0.206798 0.363443 Si\n0.244229 0.244229 0.750000 Ni\n0.755770 0.755770 0.250000 Ni\n0.756332 0.519711 0.410665 O\n0.480288 0.243668 0.910664 O\n0.000000 0.000000 0.000000 O\n0.126397 0.126397 0.250000 O\n0.000000 -0.000000 0.500000 O\n0.364756 0.853962 0.713505 O\n0.519711 0.756332 0.089335 O\n0.243668 0.480288 0.589335 O\n0.146038 0.635244 0.213505 O\n0.853962 0.364756 0.786495 O\n0.873602 0.873602 0.750000 O\n0.635244 0.146038 0.286495 O\n",
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"formula_full": "Li4 Si4 Ni2 O12",
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{
"id": "jvasp-64193",
"created_at": "2022-09-04T14:38:11.894483Z",
"updated_at": "2022-09-04T14:38:11.894504Z",
"structure_string": "Ba4 Li1 Ge1\n1.0\n0.000000 5.044819 5.044819\n5.044819 0.000000 5.044819\n5.044819 5.044819 0.000000\nBa Li Ge\n4 1 1\ndirect\n0.130129 0.623291 0.623291 Ba\n0.623291 0.623291 0.623291 Ba\n0.623291 0.130129 0.623291 Ba\n0.623291 0.623291 0.130129 Ba\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Ge\n",
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{
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"created_at": "2022-09-04T14:38:11.900611Z",
"updated_at": "2022-09-04T14:38:11.900642Z",
"structure_string": "Li2 Mg1 Ga1\n1.0\n-9.969821 -0.000000 -5.756079\n-9.817514 -0.082601 5.492276\n-6.556840 9.139978 -0.155378\nLi Mg Ga\n2 1 1\ndirect\n0.736978 -0.000000 -0.000000 Li\n0.263022 -0.000000 -0.000000 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 -0.000000 -0.000000 Ga\n",
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{
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"created_at": "2022-09-04T14:38:11.900754Z",
"updated_at": "2022-09-04T14:38:11.900780Z",
"structure_string": "K12 U4 O8 F20\n1.0\n8.309203 0.000002 -3.740145\n-1.683518 8.136869 -3.740143\n0.000260 0.000318 11.100623\nK U O F\n12 4 8 20\ndirect\n0.125000 0.375000 0.250000 K\n0.874999 0.625000 0.750000 K\n0.625000 0.875000 0.250000 K\n0.375000 0.125000 0.750000 K\n0.229285 -0.000851 0.029259 K\n0.030109 0.729285 0.529259 K\n0.499149 0.299974 0.529259 K\n0.799973 0.530109 0.029259 K\n0.770715 0.000851 0.970741 K\n0.969890 0.270715 0.470742 K\n0.500851 0.700026 0.470742 K\n0.200026 0.469891 0.970741 K\n0.396694 0.646694 0.793388 U\n0.603306 0.353306 0.206612 U\n0.853306 0.103306 0.706612 U\n0.146694 0.896694 0.293388 U\n0.653148 0.154710 0.204990 O\n0.050280 0.153148 0.704989 O\n0.654709 0.051841 0.704990 O\n0.551841 0.550280 0.204990 O\n0.346851 0.845291 0.795011 O\n0.949720 0.846852 0.295011 O\n0.345290 0.948159 0.295011 O\n0.448159 0.449720 0.795011 O\n0.019852 0.769852 0.039704 F\n0.126682 0.545099 0.713725 F\n0.168625 0.626682 0.213725 F\n0.045099 0.087043 0.213725 F\n0.587042 0.668626 0.713725 F\n0.269852 0.519852 0.539704 F\n0.873318 0.454901 0.286276 F\n0.954900 0.912957 0.786276 F\n0.351396 0.727445 0.994000 F\n0.266555 0.851397 0.494000 F\n0.227444 0.142604 0.494000 F\n0.642603 0.766556 0.994000 F\n0.648603 0.272555 0.006000 F\n0.733444 0.148603 0.506000 F\n0.412957 0.331374 0.286275 F\n0.357396 0.233444 0.006000 F\n0.980147 0.230148 0.960296 F\n0.730147 0.480148 0.460296 F\n0.831374 0.373318 0.786276 F\n0.772555 0.857396 0.506000 F\n",
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"formula_full": "K12 U4 O8 F20",
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{
"id": "jvasp-86782",
"created_at": "2022-09-04T14:38:11.909448Z",
"updated_at": "2022-09-04T14:38:11.909469Z",
"structure_string": "Cd2 Os1 C6 N6\n1.0\n6.382181 -0.000000 0.000000\n-3.191091 5.527131 -0.000000\n-0.000000 0.000000 6.674901\nCd Os C N\n2 1 6 6\ndirect\n0.333333 0.666667 0.500031 Cd\n0.666667 0.333333 0.499969 Cd\n0.000000 0.000000 0.000000 Os\n0.999977 0.748645 0.816264 C\n0.251355 0.251333 0.816264 C\n0.748667 0.000023 0.816264 C\n0.251333 0.999977 0.183735 C\n0.748645 0.748667 0.183735 C\n0.000023 0.251355 0.183735 C\n0.612029 0.612046 0.303339 N\n0.000017 0.387971 0.303339 N\n0.612046 0.000017 0.696661 N\n0.387953 0.999983 0.303339 N\n0.999983 0.612029 0.696661 N\n0.387971 0.387953 0.696661 N\n",
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{
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"created_at": "2022-09-04T14:38:11.910468Z",
"updated_at": "2022-09-04T14:38:11.910493Z",
"structure_string": "Tb2 Cu2 Sb4\n1.0\n4.321538 0.000000 -0.000000\n-0.000000 4.321538 0.000000\n-0.000000 0.000000 9.887059\nTb Cu Sb\n2 2 4\ndirect\n0.500000 0.000000 0.750710 Tb\n0.000000 0.500000 0.249290 Tb\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 0.338485 Sb\n0.000000 0.500000 0.661515 Sb\n0.500000 0.500000 0.000000 Sb\n0.000000 0.000000 0.000000 Sb\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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"structure_string": "P4 Pb2 Xe6 F36\n1.0\n8.573621 0.050643 1.025057\n0.077640 8.573419 1.025057\n0.119725 0.119349 10.667954\nP Pb Xe F\n4 2 6 36\ndirect\n0.198131 0.198132 0.396276 P\n-0.000000 0.500000 0.000000 P\n0.801868 0.801868 0.603724 P\n0.500000 -0.000000 0.000000 P\n0.288959 0.288959 0.719515 Pb\n0.711041 0.711041 0.280485 Pb\n0.000000 0.000000 0.000000 Xe\n0.500000 0.500000 0.000000 Xe\n0.321507 0.798209 0.661917 Xe\n0.201791 0.678492 0.338083 Xe\n0.798208 0.321508 0.661918 Xe\n0.678492 0.201791 0.338083 Xe\n0.064314 0.334862 0.400657 F\n0.873156 0.403158 0.940128 F\n0.334861 0.064314 0.400657 F\n0.903758 0.903758 0.678344 F\n0.723391 0.428649 0.374463 F\n0.276608 0.571351 0.625538 F\n0.620874 0.025592 0.869658 F\n0.126843 0.596842 0.059873 F\n0.665138 0.935686 0.599343 F\n0.428648 0.723392 0.374462 F\n0.379125 0.974408 0.130342 F\n0.917074 0.917074 0.187989 F\n0.082925 0.082926 0.812011 F\n0.624977 0.976183 0.312294 F\n0.976183 0.624978 0.312294 F\n0.614162 0.856133 0.058261 F\n0.693054 0.693054 0.523774 F\n0.974407 0.379125 0.130343 F\n0.287461 0.287461 0.264295 F\n0.856133 0.614162 0.058261 F\n0.935685 0.665138 0.599343 F\n0.385838 0.143867 0.941739 F\n0.143867 0.385838 0.941739 F\n0.375022 0.023817 0.687706 F\n0.025592 0.620875 0.869658 F\n0.596842 0.126843 0.059873 F\n0.306946 0.306946 0.476227 F\n0.531174 0.531174 0.186233 F\n0.883276 0.883277 0.463562 F\n0.023817 0.375022 0.687706 F\n0.571351 0.276608 0.625538 F\n0.468826 0.468826 0.813767 F\n0.096241 0.096242 0.321656 F\n0.403157 0.873157 0.940128 F\n0.116723 0.116723 0.536438 F\n0.712538 0.712539 0.735705 F\n",
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{
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"structure_string": "Ti1 Be2 Pt1\n1.0\n-2.061935 2.061935 2.915905\n2.061935 -2.061935 2.915905\n2.061935 2.061935 -2.915905\nTi Be Pt\n1 2 1\ndirect\n0.749998 0.250000 0.499999 Ti\n0.000000 0.000000 0.000000 Be\n0.250000 0.749998 0.499999 Be\n0.499999 0.499999 0.000000 Pt\n",
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]
}