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{
"id": "jvasp-112062",
"created_at": "2022-09-04T14:38:43.130181Z",
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"structure_string": "Ti1 H24 C13 O4\n1.0\n4.892578 0.018107 0.447287\n0.107315 6.342959 1.737824\n0.310317 0.350223 11.456363\nTi H C O\n1 24 13 4\ndirect\n0.943160 0.943092 0.843950 Ti\n0.542461 0.493762 0.170733 H\n0.482956 0.360270 0.064602 H\n0.708789 0.248836 0.503259 H\n0.972553 0.420013 0.106060 H\n0.407679 0.409381 0.509004 H\n0.294183 0.215673 0.326096 H\n0.934638 0.219820 0.345018 H\n0.838552 0.333970 0.864894 H\n0.183621 0.059392 0.135114 H\n0.235961 0.895300 0.281355 H\n0.066033 0.603706 0.769513 H\n0.036887 0.561459 0.208525 H\n0.669371 0.064076 0.211474 H\n0.806114 0.822441 0.194113 H\n0.843076 0.136722 0.010975 H\n0.926684 0.428224 0.632473 H\n0.642818 0.604715 0.628137 H\n0.069103 0.741424 0.476046 H\n0.159545 0.257637 0.927577 H\n0.116650 0.835371 0.637902 H\n0.642994 0.935523 0.434831 H\n0.512024 0.737539 0.383171 H\n0.378848 0.751354 0.739248 H\n0.997639 0.559039 0.397952 H\n0.398577 0.485519 0.105427 C\n0.811130 0.933410 0.249455 C\n0.112368 0.430281 0.172045 C\n0.112701 0.220596 0.276877 C\n0.102138 0.021315 0.232531 C\n0.702432 0.819192 0.383560 C\n0.427445 0.691797 0.002263 C\n0.766665 0.509785 0.576331 C\n0.584349 0.339643 0.557694 C\n0.480953 0.181348 0.677900 C\n0.157597 0.762590 0.733593 C\n0.957252 0.202206 0.919697 C\n0.901205 0.656905 0.455260 C\n0.676507 0.744312 0.958430 O\n0.667114 0.067289 0.741096 O\n0.221198 0.801067 0.964555 O\n0.230395 0.161849 0.712535 O\n",
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{
"id": "jvasp-110897",
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"structure_string": "Nd2 Si2 Os4 C2\n1.0\n5.926886 -0.002504 0.000000\n-4.589529 3.750227 0.000000\n-0.000000 -0.000000 7.204064\nNd Si Os C\n2 2 4 2\ndirect\n0.549163 0.450839 0.250000 Nd\n0.450839 0.549163 0.750000 Nd\n0.270434 0.729568 0.250000 Si\n0.729568 0.270434 0.750000 Si\n0.834049 0.165953 0.058796 Os\n0.165953 0.834049 0.941204 Os\n0.165953 0.834049 0.558795 Os\n0.834049 0.165953 0.441204 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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"density_atomic": 0.062483149189664584,
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"formula_full": "Nd2 Si2 Os4 C2",
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{
"id": "jvasp-41761",
"created_at": "2022-09-04T14:37:30.344211Z",
"updated_at": "2022-09-04T14:37:30.344235Z",
"structure_string": "Ta1 Ti1 Ru2\n1.0\n0.000013 3.128145 3.128145\n3.128145 0.000013 3.128145\n3.128145 3.128145 0.000013\nTa Ti Ru\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ta\n0.750001 0.750001 0.750001 Ti\n0.000001 0.000001 0.000001 Ru\n0.499999 0.499999 0.499999 Ru\n",
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{
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"updated_at": "2022-09-04T14:36:12.279597Z",
"structure_string": "U2 C1 S1\n1.0\n3.533820 0.022186 5.594143\n1.635599 3.132601 5.594143\n0.036355 0.022186 6.616721\nU C S\n2 1 1\ndirect\n0.261717 0.261718 0.261717 U\n0.738282 0.738284 0.738282 U\n0.000000 0.000000 0.000000 C\n0.499999 0.500001 0.499999 S\n",
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{
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"structure_string": "Si6 N8\n1.0\n4.776644 0.000000 2.757796\n1.592215 4.503463 2.757796\n-0.000000 -0.000000 5.515594\nSi N\n6 8\ndirect\n0.500000 0.000000 0.500000 Si\n0.000001 0.500000 0.500000 Si\n0.500000 0.500000 0.000001 Si\n0.500000 0.500000 0.500000 Si\n0.125000 0.125000 0.125000 Si\n0.875000 0.874999 0.875001 Si\n0.742564 0.742563 0.742564 N\n0.257437 0.257436 0.727689 N\n0.257437 0.727689 0.257437 N\n0.727689 0.257436 0.257437 N\n0.742563 0.272311 0.742564 N\n0.272311 0.742563 0.742563 N\n0.257437 0.257436 0.257437 N\n0.742564 0.742563 0.272312 N\n",
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{
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{
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"created_at": "2022-09-04T14:38:34.701838Z",
"updated_at": "2022-09-04T14:38:34.701872Z",
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{
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"updated_at": "2022-09-04T14:37:52.367135Z",
"structure_string": "Hf2 Os1 Rh1\n1.0\n0.000000 3.258408 3.258408\n3.258408 -0.000000 3.258408\n3.258408 3.258408 0.000000\nHf Os Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500001 0.500001 0.500001 Hf\n0.250001 0.250001 0.250001 Os\n0.750000 0.750000 0.750000 Rh\n",
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{
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{
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{
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}