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{
"id": "jvasp-57366",
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"structure_string": "Sm2 Mo2 Cl2 O8\n1.0\n6.200994 -0.000212 1.501898\n1.793357 5.936007 1.501898\n0.011467 0.008514 6.940336\nSm Mo Cl O\n2 2 2 8\ndirect\n0.221821 0.221820 0.889408 Sm\n0.778180 0.778181 0.110593 Sm\n0.637392 0.637391 0.730826 Mo\n0.362609 0.362609 0.269175 Mo\n0.010180 0.010179 0.239570 Cl\n0.989821 0.989821 0.760431 Cl\n0.116473 0.489530 0.152106 O\n0.706126 0.706126 0.468764 O\n0.460930 0.460929 0.793673 O\n0.293875 0.293874 0.531237 O\n0.539071 0.539071 0.206328 O\n0.510470 0.883527 0.847895 O\n0.883527 0.510470 0.847895 O\n0.489530 0.116473 0.152106 O\n",
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{
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"structure_string": "Cr4 Hg2 S8\n1.0\n6.197758 0.000000 3.578278\n2.065919 5.843303 3.578278\n-0.000000 -0.000000 7.156555\nCr Hg S\n4 2 8\ndirect\n0.500000 0.000000 0.500000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.125000 0.125000 0.125000 Hg\n0.875000 0.875000 0.875000 Hg\n0.732500 0.732499 0.732500 S\n0.267500 0.267500 0.697499 S\n0.267501 0.697499 0.267500 S\n0.697499 0.267500 0.267500 S\n0.732500 0.302501 0.732499 S\n0.302501 0.732499 0.732500 S\n0.267500 0.267500 0.267500 S\n0.732500 0.732499 0.302501 S\n",
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{
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"structure_string": "Li2 Ti2 V2 O8\n1.0\n5.823155 -0.000000 -0.000000\n2.911578 5.143058 -0.011102\n2.911578 1.703886 4.852621\nLi Ti V O\n2 2 2 8\ndirect\n0.127665 0.122335 0.122334 Li\n0.872334 0.877667 0.877666 Li\n0.500000 0.000000 0.500000 Ti\n0.500000 0.500000 0.000000 Ti\n-0.000000 0.500001 0.500000 V\n0.500000 0.500001 0.500000 V\n0.263270 0.259248 0.259248 O\n0.262808 0.258467 0.715915 O\n0.262808 0.715916 0.258467 O\n0.718232 0.259248 0.259248 O\n0.281767 0.740753 0.740752 O\n0.737191 0.741534 0.284084 O\n0.737191 0.284084 0.741534 O\n0.736729 0.740753 0.740752 O\n",
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{
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"created_at": "2022-09-04T14:38:02.090580Z",
"updated_at": "2022-09-04T14:38:02.090600Z",
"structure_string": "Li1 V5 O7 F1\n1.0\n-0.000000 4.240071 4.240071\n4.240071 -0.000000 4.240071\n4.162602 4.162602 0.077470\nLi V O F\n1 5 7 1\ndirect\n0.241204 0.241204 0.276387 Li\n0.008021 0.008021 0.975938 V\n0.622411 0.622411 0.132769 V\n0.635239 0.122200 0.607319 V\n0.122200 0.635239 0.607319 V\n0.635239 0.635239 0.607319 V\n0.843707 0.380665 0.394961 O\n0.380665 0.380665 0.394961 O\n0.380665 0.843707 0.394961 O\n0.872538 0.872538 0.382386 O\n0.868136 0.394390 0.869338 O\n0.394390 0.868136 0.869338 O\n0.868136 0.868136 0.869338 O\n0.377446 0.377446 0.867661 F\n",
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{
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"created_at": "2022-09-04T14:37:37.227776Z",
"updated_at": "2022-09-04T14:37:37.227795Z",
"structure_string": "Li2 Mg2 V2 O8\n1.0\n5.161762 0.009923 0.000000\n-2.063135 4.731529 -0.000000\n-0.000000 0.000000 6.244038\nLi Mg V O\n2 2 2 8\ndirect\n0.838319 0.161680 0.250000 Li\n0.161680 0.838320 0.750000 Li\n0.499999 0.500000 0.000000 Mg\n0.499999 0.500000 0.500000 Mg\n0.144994 0.855005 0.250000 V\n0.855004 0.144994 0.750000 V\n0.259025 0.740974 0.472637 O\n0.736282 0.772982 0.750000 O\n0.263717 0.227018 0.250000 O\n0.740973 0.259026 0.972637 O\n0.740973 0.259026 0.527363 O\n0.772981 0.736283 0.250000 O\n0.227017 0.263717 0.750000 O\n0.259025 0.740974 0.027363 O\n",
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{
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"created_at": "2022-09-04T14:38:03.731311Z",
"updated_at": "2022-09-04T14:38:03.731331Z",
"structure_string": "Tb2 H6 O6\n1.0\n3.146269 -5.449498 0.000000\n3.146269 5.449498 0.000000\n0.000000 0.000000 3.569681\nTb H O\n2 6 6\ndirect\n0.666667 0.333333 0.250000 Tb\n0.333333 0.666667 0.750000 Tb\n0.134729 0.860995 0.250000 H\n0.726266 0.865271 0.250000 H\n0.139005 0.273734 0.250000 H\n0.865271 0.139006 0.750000 H\n0.273734 0.134729 0.750000 H\n0.860995 0.726266 0.750000 H\n0.310058 0.916808 0.250000 O\n0.606751 0.689943 0.250000 O\n0.083192 0.393250 0.250000 O\n0.689943 0.083192 0.750000 O\n0.393250 0.310058 0.750000 O\n0.916808 0.606751 0.750000 O\n",
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"volume": 122.40854960368323,
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{
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"created_at": "2022-09-04T14:38:01.974464Z",
"updated_at": "2022-09-04T14:38:01.974476Z",
"structure_string": "Ag6 Sb2 S6\n1.0\n6.816738 0.199941 -1.548152\n-1.980614 6.525723 -1.548152\n0.143768 0.199941 6.988849\nAg Sb S\n6 2 6\ndirect\n0.421271 0.749486 0.938444 Ag\n0.938445 0.421270 0.749487 Ag\n0.921271 0.438444 0.249487 Ag\n0.438444 0.249486 0.921271 Ag\n0.749487 0.938443 0.421271 Ag\n0.249487 0.921270 0.438444 Ag\n0.510490 0.510489 0.510489 Sb\n0.010489 0.010489 0.010489 Sb\n0.096505 0.763138 0.746565 S\n0.763139 0.746564 0.096505 S\n0.263139 0.596504 0.246565 S\n0.596505 0.246565 0.263139 S\n0.746565 0.096504 0.763139 S\n0.246565 0.263138 0.596505 S\n",
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{
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"created_at": "2022-09-04T14:37:44.755065Z",
"updated_at": "2022-09-04T14:37:44.755075Z",
"structure_string": "Ba4 In2 Cl2 O6\n1.0\n4.263518 -0.000000 -0.000000\n-0.000000 4.263518 0.000000\n-0.000000 0.000000 15.158990\nBa In Cl O\n4 2 2 6\ndirect\n0.000000 0.500000 0.095640 Ba\n0.000000 0.500000 0.353742 Ba\n0.500000 0.000000 0.646258 Ba\n0.500000 0.000000 0.904360 Ba\n0.000000 0.500000 0.786005 In\n0.500000 0.000000 0.213995 In\n0.000000 0.500000 0.573211 Cl\n0.500000 0.000000 0.426789 Cl\n0.500000 0.000000 0.074724 O\n0.500000 0.500000 0.238680 O\n0.000000 0.000000 0.761320 O\n0.000000 0.500000 0.925276 O\n0.500000 0.500000 0.761320 O\n0.000000 0.000000 0.238680 O\n",
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{
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"structure_string": "Ag4 Ge2 O8\n1.0\n-0.000000 6.015074 5.159679\n2.996419 0.000000 5.159679\n2.996419 6.015074 0.000000\nAg Ge O\n4 2 8\ndirect\n0.220440 0.220440 0.529560 Ag\n0.529560 0.529561 0.220440 Ag\n0.779560 0.779561 0.470440 Ag\n0.470439 0.470441 0.779560 Ag\n0.125000 0.125000 0.125000 Ge\n0.874999 0.875001 0.875000 Ge\n0.145783 0.325068 0.262223 O\n0.766923 0.262224 0.325067 O\n0.262223 0.766924 0.145783 O\n0.325067 0.145784 0.766923 O\n0.674932 0.854217 0.233076 O\n0.737776 0.233077 0.854216 O\n0.233076 0.737777 0.674932 O\n0.854216 0.674933 0.737776 O\n",
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{
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"structure_string": "Li2 Cr3 Cu1 O8\n1.0\n5.823820 0.028895 0.020431\n2.936932 5.029129 0.020432\n2.936932 1.695639 4.734698\nLi Cr Cu O\n2 3 1 8\ndirect\n0.121262 0.121262 0.121262 Li\n0.499537 0.499537 0.499537 Li\n0.007118 0.497530 0.497530 Cr\n0.497530 0.007118 0.497530 Cr\n0.497530 0.497530 0.007119 Cr\n0.878199 0.878199 0.878200 Cu\n0.258799 0.258799 0.258799 O\n0.250073 0.250073 0.711585 O\n0.250073 0.711585 0.250073 O\n0.711585 0.250073 0.250073 O\n0.291512 0.748541 0.748541 O\n0.748541 0.291512 0.748541 O\n0.748541 0.748541 0.291512 O\n0.739696 0.739696 0.739696 O\n",
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{
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"structure_string": "Li2 Fe2 Si2 O8\n1.0\n5.132556 0.054058 0.000000\n-0.170281 5.130015 -0.000000\n0.000000 -0.000000 6.577377\nLi Fe Si O\n2 2 2 8\ndirect\n0.308599 0.691401 0.500000 Li\n0.691402 0.308599 0.000000 Li\n0.319087 0.680913 0.000000 Fe\n0.680914 0.319087 0.500000 Fe\n0.175278 0.175278 0.250000 Si\n0.824722 0.824721 0.750000 Si\n0.139170 0.768292 0.760179 O\n0.231708 0.860830 0.239821 O\n0.317279 0.302398 0.452839 O\n0.302398 0.317278 0.047161 O\n0.697603 0.682721 0.547162 O\n0.682722 0.697602 0.952839 O\n0.768293 0.139170 0.739822 O\n0.860831 0.231708 0.260179 O\n",
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{
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"structure_string": "Li2 Cr2 Si2 O8\n1.0\n-4.059549 4.022002 0.117923\n4.059549 0.117923 4.022002\n-0.000000 3.904079 -3.904079\nLi Cr Si O\n2 2 2 8\ndirect\n0.995937 0.004061 0.004062 Li\n0.254061 0.745937 0.245938 Li\n0.624999 0.874999 0.625000 Cr\n0.125000 0.375000 0.625000 Cr\n0.624999 0.374999 0.625000 Si\n0.624999 0.374999 0.125000 Si\n0.844390 0.155610 0.893175 O\n0.844390 0.155610 0.418045 O\n0.420388 0.161781 0.870698 O\n0.838217 0.579611 0.870698 O\n0.411781 0.170388 0.379303 O\n0.829611 0.588217 0.379303 O\n0.405609 0.594390 0.356825 O\n0.405609 0.594390 0.831955 O\n",
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]
}