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{
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{
"id": "jvasp-115344",
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"structure_string": "Ti1 Sn1 O1\n1.0\n6.604132 0.000000 0.000000\n0.000000 6.604132 0.000000\n0.000000 0.000000 4.762595\nTi Sn O\n1 1 1\ndirect\n-0.073571 -0.016164 0.000000 Ti\n-0.000100 0.331433 0.000000 Sn\n0.276802 0.000343 0.000000 O\n",
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"spacegroup": 6
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{
"id": "jvasp-101089",
"created_at": "2022-09-04T14:37:15.141449Z",
"updated_at": "2022-09-04T14:37:15.141471Z",
"structure_string": "Ti1 Sn1 Ir1\n1.0\n3.797632 -0.000000 2.192564\n1.265877 3.580442 2.192564\n-0.000000 -0.000000 4.385128\nTi Sn Ir\n1 1 1\ndirect\n0.500000 0.500000 0.499999 Ti\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Ir\n",
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{
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"created_at": "2022-09-04T14:38:54.976120Z",
"updated_at": "2022-09-04T14:38:54.976157Z",
"structure_string": "Ti1 Sn7\n1.0\n6.566046 -0.000000 -0.000000\n-0.000000 6.566046 0.000000\n0.000000 -0.000000 6.566046\nTi Sn\n1 7\ndirect\n0.000000 0.000000 0.500000 Ti\n0.242494 0.242494 0.742495 Sn\n0.000000 0.500000 0.000000 Sn\n0.242494 0.757506 0.257506 Sn\n0.500000 0.000000 0.000000 Sn\n0.757506 0.242494 0.257506 Sn\n0.500000 0.500000 0.500000 Sn\n0.757506 0.757506 0.742495 Sn\n",
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{
"id": "jvasp-91383",
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"structure_string": "Ti2 Sn12 F32\n1.0\n7.552883 0.000000 0.000000\n-3.776441 9.012771 -0.068152\n0.000000 -0.002712 11.089981\nTi Sn F\n2 12 32\ndirect\n0.338017 0.000000 0.750000 Ti\n0.661983 0.000000 0.250000 Ti\n0.113139 0.417262 0.175528 Sn\n0.894766 0.141095 0.892017 Sn\n0.753672 0.858905 0.607983 Sn\n0.246327 0.141095 0.392017 Sn\n0.521269 0.293971 0.039313 Sn\n0.105234 0.858905 0.107984 Sn\n0.478731 0.706029 0.960687 Sn\n0.772702 0.293971 0.539313 Sn\n0.304122 0.417262 0.675528 Sn\n0.886861 0.582738 0.824472 Sn\n0.695878 0.582738 0.324472 Sn\n0.227298 0.706029 0.460687 Sn\n0.411309 0.857279 0.221064 F\n0.129064 0.257502 0.011192 F\n0.128438 0.257502 0.511192 F\n0.870936 0.742498 0.988808 F\n0.554028 0.142721 0.278937 F\n0.445972 0.857279 0.721063 F\n0.314520 0.944487 0.914568 F\n0.090802 0.855869 0.714838 F\n0.234933 0.144131 0.785162 F\n0.909198 0.144131 0.285162 F\n0.765067 0.855869 0.214838 F\n0.370031 0.055513 0.585432 F\n0.871562 0.742498 0.488808 F\n0.588691 0.142721 0.778936 F\n0.719705 0.445147 0.160732 F\n0.505007 0.319760 0.458162 F\n0.280294 0.554853 0.839268 F\n0.725443 0.445148 0.660732 F\n0.814753 0.319760 0.958162 F\n0.494993 0.680240 0.541838 F\n0.185247 0.680240 0.041838 F\n0.629968 0.944487 0.414568 F\n0.592224 0.472506 0.905461 F\n0.119718 0.527494 0.594538 F\n0.407776 0.527494 0.094539 F\n0.880282 0.472506 0.405462 F\n0.003241 0.300355 0.746067 F\n0.702886 0.699645 0.753933 F\n0.996759 0.699645 0.253933 F\n0.297114 0.300355 0.246067 F\n0.274557 0.554853 0.339268 F\n0.685480 0.055513 0.085432 F\n",
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"formula_full": "Ti2 Sn12 F32",
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{
"id": "jvasp-39669",
"created_at": "2022-09-04T14:37:49.212110Z",
"updated_at": "2022-09-04T14:37:49.212134Z",
"structure_string": "Ti1 Si1 Tc2\n1.0\n0.000000 3.038075 3.038075\n3.038075 -0.000000 3.038075\n3.038075 3.038075 0.000000\nTi Si Tc\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Ti\n0.250000 0.250000 0.250000 Si\n0.000000 0.000000 0.000000 Tc\n0.499999 0.499999 0.499999 Tc\n",
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{
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"created_at": "2022-09-04T14:37:38.660502Z",
"updated_at": "2022-09-04T14:37:38.660512Z",
"structure_string": "Ti1 Si1 Ru2\n1.0\n0.000000 3.003990 3.003990\n3.003990 -0.000000 3.003990\n3.003990 3.003990 -0.000000\nTi Si Ru\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Ti\n0.250000 0.250000 0.250000 Si\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 Ru\n",
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{
"id": "jvasp-21703",
"created_at": "2022-09-04T14:38:36.415878Z",
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"structure_string": "Ti6 Si6 Ru6\n1.0\n5.840039 0.000000 -2.859786\n-1.662578 6.014109 -3.395191\n0.000875 -0.020359 7.394721\nTi Si Ru\n6 6 6\ndirect\n0.045061 0.026068 0.552133 Ti\n0.100732 0.554671 0.609341 Ti\n0.920617 0.753351 0.006703 Ti\n0.491391 0.445329 0.390659 Ti\n0.492926 0.973932 0.447866 Ti\n0.913913 0.246649 0.993296 Ti\n0.538638 0.781865 0.063729 Si\n0.474908 0.218135 0.936270 Si\n0.827412 0.338705 0.664996 Si\n0.162415 0.661294 0.335003 Si\n0.162415 0.173708 0.335002 Si\n0.827412 0.826292 0.664997 Si\n0.496880 0.408910 0.746913 Ru\n0.245327 0.500000 -0.000000 Ru\n0.245328 -0.000000 -0.000000 Ru\n0.496881 0.838000 0.746913 Ru\n0.749967 0.591090 0.253086 Ru\n0.749968 0.162000 0.253086 Ru\n",
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{
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{
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{
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]
}