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{
"id": "jvasp-98641",
"created_at": "2022-09-04T14:35:49.165629Z",
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"structure_string": "Ga2 H24 N6 O6 F12\n1.0\n5.857995 0.256518 1.238357\n2.321830 7.100714 0.443519\n0.728323 -0.177731 10.344862\nGa H N O F\n2 24 6 6 12\ndirect\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Ga\n0.054558 0.196734 0.496817 H\n0.326416 0.879053 0.616553 H\n0.673585 0.120947 0.383447 H\n0.056262 0.051433 0.690030 H\n0.943738 0.948566 0.309970 H\n0.322421 0.105281 0.638436 H\n0.677580 0.894719 0.361564 H\n0.968656 0.465671 0.343474 H\n0.031344 0.534329 0.656527 H\n0.336861 0.364660 0.102314 H\n0.663139 0.635339 0.897686 H\n0.945442 0.803266 0.503183 H\n0.787598 0.790057 0.806281 H\n0.379659 0.315945 0.257073 H\n0.620341 0.684055 0.742927 H\n0.739632 0.451358 0.063162 H\n0.260368 0.548641 0.936838 H\n0.439864 0.835006 0.139067 H\n0.560136 0.164994 0.860934 H\n0.587386 0.682389 0.243238 H\n0.412614 0.317610 0.756762 H\n0.761339 0.742656 0.096939 H\n0.212403 0.209943 0.193719 H\n0.238661 0.257343 0.903061 H\n0.774605 0.974362 0.382907 N\n0.255771 0.331525 0.199139 N\n0.225395 0.025638 0.617093 N\n0.597723 0.717210 0.142838 N\n0.402277 0.282790 0.857162 N\n0.744229 0.668475 0.800861 N\n0.415528 0.431498 -0.069519 O\n0.584473 0.568502 0.069519 O\n-0.036631 0.505567 0.752087 O\n0.036631 0.494433 0.247913 O\n0.801306 0.928099 0.514923 O\n0.198694 0.071901 0.485078 O\n0.149305 0.608766 0.512089 F\n0.850695 0.391234 0.487911 F\n0.441477 0.292026 0.600964 F\n0.558524 0.707974 0.399036 F\n0.035420 0.732318 0.994255 F\n0.145469 0.976100 0.154278 F\n0.314642 -0.050004 0.877719 F\n0.685358 0.050004 0.122281 F\n0.854532 0.023900 0.845722 F\n0.561861 0.355204 0.340393 F\n0.964581 0.267682 0.005745 F\n0.438140 0.644796 0.659608 F\n",
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{
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"structure_string": "Be1 Si2 Sb1\n1.0\n-2.212440 2.212440 3.603953\n2.212440 -2.212440 3.603953\n2.212440 2.212440 -3.603953\nBe Si Sb\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Si\n0.250000 0.750000 0.500000 Si\n0.750000 0.250000 0.500000 Sb\n",
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{
"id": "jvasp-115334",
"created_at": "2022-09-04T14:38:44.181985Z",
"updated_at": "2022-09-04T14:38:44.182012Z",
"structure_string": "Ta1 Sn1 O3\n1.0\n4.064140 0.000000 0.000000\n-0.000000 4.064140 0.000000\n0.000000 -0.000000 4.064140\nTa Sn O\n1 1 3\ndirect\n0.500001 0.500001 0.500001 Ta\n0.000000 0.000000 0.000000 Sn\n0.500001 0.000000 0.500001 O\n0.500001 0.500001 0.000000 O\n0.000000 0.500001 0.500001 O\n",
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{
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"created_at": "2022-09-04T14:35:52.929818Z",
"updated_at": "2022-09-04T14:35:52.929845Z",
"structure_string": "Ti2 Be1 Bi1\n1.0\n3.539935 -0.000000 0.000000\n-0.000000 3.539935 0.000000\n0.000000 0.000000 5.722902\nTi Be Bi\n2 1 1\ndirect\n0.000000 0.000000 0.038917 Ti\n0.500001 0.500001 0.252636 Ti\n0.000000 0.000000 0.460816 Be\n0.500001 0.500001 0.747630 Bi\n",
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{
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"structure_string": "U2 Pd4 S8\n1.0\n6.056830 -0.000001 -2.994200\n-1.480186 5.873179 -2.994201\n0.006381 0.008188 7.636047\nU Pd S\n2 4 8\ndirect\n0.375000 0.125000 0.750000 U\n0.624999 0.875000 0.250000 U\n-0.000000 0.500000 -0.000000 Pd\n0.500000 0.500000 0.500000 Pd\n-0.000000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n0.233855 0.528572 0.855044 S\n0.326472 0.733856 0.355044 S\n0.028571 0.121188 0.355044 S\n0.621188 0.826473 0.855044 S\n0.766144 0.471429 0.144956 S\n0.673527 0.266145 0.644957 S\n0.378812 0.173528 0.144956 S\n0.971428 0.878812 0.644957 S\n",
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"structure_string": "Ca1 Mn2 Be1\n1.0\n-1.997828 1.997828 4.030562\n1.997828 -1.997828 4.030562\n1.997828 1.997828 -4.030562\nCa Mn Be\n1 2 1\ndirect\n0.750000 0.250000 0.500001 Ca\n0.000000 0.000000 0.000000 Mn\n0.250000 0.750000 0.500001 Mn\n0.500000 0.500000 0.000000 Be\n",
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{
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"created_at": "2022-09-04T14:38:54.900387Z",
"updated_at": "2022-09-04T14:38:54.900409Z",
"structure_string": "As5 Pt1\n1.0\n1.850424 -3.205026 -0.000000\n1.850424 3.205026 0.000000\n0.000000 0.000000 10.803257\nAs Pt\n5 1\ndirect\n0.000000 0.000000 0.786711 As\n0.000000 0.000000 0.219987 As\n0.666666 0.333332 0.085315 As\n0.666666 0.333332 0.568168 As\n0.333332 0.666666 0.440138 As\n0.333332 0.666666 0.899681 Pt\n",
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{
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"structure_string": "Ba2 Tb2 Mn4 O12\n1.0\n5.513420 0.012567 0.000000\n0.088489 5.512722 0.000000\n0.000000 0.000000 7.696393\nTb Ba Mn O\n2 2 4 12\ndirect\n0.237458 0.237458 0.500000 Tb\n0.762543 0.762543 0.500000 Tb\n0.247114 0.247114 0.000000 Ba\n0.752886 0.752886 0.000000 Ba\n0.749578 0.250423 0.258415 Mn\n0.250422 0.749578 0.258415 Mn\n0.250422 0.749578 0.741584 Mn\n0.749578 0.250423 0.741584 Mn\n0.730343 0.269658 0.000000 O\n0.500000 0.000000 0.715372 O\n0.000000 0.000000 0.760352 O\n0.500000 0.500000 0.689510 O\n0.000000 0.500000 0.284628 O\n0.269657 0.730343 0.000000 O\n0.500000 0.500000 0.310490 O\n0.193948 0.806052 0.500000 O\n0.000000 0.000000 0.239648 O\n0.500000 0.000000 0.284628 O\n0.806052 0.193948 0.500000 O\n0.000000 0.500000 0.715372 O\n",
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