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{
"id": "jvasp-52793",
"created_at": "2022-09-04T14:35:43.966275Z",
"updated_at": "2022-09-04T14:35:43.966304Z",
"structure_string": "Mn2 P2 O8\n1.0\n-4.994958 0.049774 0.033184\n1.449670 4.863421 -0.010497\n-0.125788 -1.178794 -6.051149\nMn P O\n2 2 8\ndirect\n0.133186 0.732004 0.702128 Mn\n0.866814 0.267996 0.297873 Mn\n0.708493 0.145580 0.786169 P\n0.291508 0.854420 0.213832 P\n0.395678 0.077270 0.711958 O\n0.802443 0.882359 0.755809 O\n0.877009 0.347838 0.631225 O\n0.749918 0.316068 0.023314 O\n0.197557 0.117641 0.244193 O\n0.250083 0.683932 0.976687 O\n0.122992 0.652162 0.368777 O\n0.604322 0.922730 0.288043 O\n",
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{
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"structure_string": "Li4 Fe4 Si4 O16\n1.0\n0.000000 5.037405 -0.000717\n6.357628 0.000000 0.000000\n0.000000 -0.002270 -10.743678\nLi Fe Si O\n4 4 4 16\ndirect\n0.260192 0.232441 0.837547 Li\n0.760187 0.267557 0.161894 Li\n0.760187 0.732444 0.661894 Li\n0.260192 0.767559 0.337547 Li\n0.260838 0.529074 0.084252 Fe\n0.260838 0.470926 0.584252 Fe\n0.760863 0.970918 0.915197 Fe\n0.760863 0.029082 0.415197 Fe\n0.763869 0.228771 0.673321 Si\n0.763869 0.771229 0.173321 Si\n0.263876 0.728770 0.826125 Si\n0.263876 0.271230 0.326124 Si\n0.589211 0.242664 0.325064 O\n0.650228 0.201429 0.816601 O\n0.129563 0.056930 0.386704 O\n0.692493 0.018894 0.587698 O\n0.692493 0.981107 0.087698 O\n0.129563 0.943070 0.886704 O\n0.650228 0.798571 0.316600 O\n0.192497 0.481109 0.411745 O\n0.089205 0.742655 0.174384 O\n0.150207 0.701443 0.682840 O\n0.629550 0.556922 0.112743 O\n0.192497 0.518891 0.911746 O\n0.089205 0.257345 0.674384 O\n0.629550 0.443079 0.612743 O\n0.589211 0.757336 0.825064 O\n0.150207 0.298557 0.182840 O\n",
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{
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"structure_string": "Yb4 O4 F4\n1.0\n0.000000 5.499175 0.033654\n4.852949 0.000000 0.000000\n0.000000 -0.743113 -5.530167\nYb O F\n4 4 4\ndirect\n0.727274 0.500083 0.757287 Yb\n0.772726 0.000083 0.242715 Yb\n0.272726 0.499917 0.242714 Yb\n0.227274 0.999917 0.757287 Yb\n0.000492 0.656622 0.500340 O\n0.499508 0.156622 0.499661 O\n0.999508 0.343378 0.499662 O\n0.500491 0.843378 0.500340 O\n0.500067 0.253372 0.999820 F\n0.999932 0.753372 0.000182 F\n0.499932 0.746628 0.000182 F\n0.000068 0.246628 0.999819 F\n",
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"formula_full": "Yb4 O4 F4",
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"spacegroup": 12
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{
"id": "jvasp-66997",
"created_at": "2022-09-04T14:36:12.735983Z",
"updated_at": "2022-09-04T14:36:12.736003Z",
"structure_string": "Be2 Nb1 V1\n1.0\n2.634231 0.000000 -0.000000\n0.000000 2.634231 0.000000\n0.000000 0.000000 7.083719\nBe Nb V\n2 1 1\ndirect\n0.000000 0.000000 0.037195 Be\n0.500000 0.500000 0.195927 Be\n0.000000 0.000000 0.464584 Nb\n0.500000 0.500000 0.802294 V\n",
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{
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"created_at": "2022-09-04T14:37:01.647201Z",
"updated_at": "2022-09-04T14:37:01.647214Z",
"structure_string": "Tb1 B2\n1.0\n1.648747 -2.855714 0.000000\n1.648747 2.855714 0.000000\n-0.000000 -0.000000 3.915061\nTb B\n1 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.333334 0.666668 0.500000 B\n0.666668 0.333334 0.500000 B\n",
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{
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"created_at": "2022-09-04T14:38:01.821607Z",
"updated_at": "2022-09-04T14:38:01.821622Z",
"structure_string": "Tb1 Fe1 C2\n1.0\n-3.657408 0.000000 0.000000\n0.000000 -2.266045 -2.965612\n0.000000 -2.266045 2.965612\nTb Fe C\n1 1 2\ndirect\n0.000000 0.996790 0.003208 Tb\n0.500000 0.385904 0.614094 Fe\n0.500000 0.855155 0.452852 C\n0.500000 0.547145 0.144842 C\n",
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{
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"created_at": "2022-09-04T14:36:45.410527Z",
"updated_at": "2022-09-04T14:36:45.410553Z",
"structure_string": "Sr1 Zn1 O3\n1.0\n3.946084 -0.000000 0.000000\n0.000000 3.946084 0.000000\n-0.000000 -0.000000 3.946084\nSr Zn O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.499999 0.499999 0.499999 Zn\n0.499999 0.499999 -0.000000 O\n0.499999 0.000000 0.499999 O\n-0.000000 0.499999 0.499999 O\n",
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{
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"created_at": "2022-09-04T14:36:58.051834Z",
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"structure_string": "U4 H8 O16\n1.0\n5.705701 -0.000000 0.000000\n0.000000 6.104473 0.000000\n0.000000 0.000000 9.879542\nU H O\n4 8 16\ndirect\n0.500000 0.000000 0.500000 U\n0.500000 0.500000 0.000000 U\n0.000000 0.000000 0.000000 U\n0.000000 0.500000 0.500000 U\n0.653513 0.342858 0.322079 H\n0.153513 0.157142 0.677921 H\n0.346487 0.842857 0.177921 H\n0.846487 0.657142 0.822079 H\n0.346487 0.657142 0.677921 H\n0.846487 0.842857 0.322079 H\n0.653513 0.157142 0.822079 H\n0.153513 0.342858 0.177921 H\n0.681519 0.303951 0.419408 O\n0.181519 0.196049 0.580592 O\n0.143499 0.458469 0.335021 O\n0.318481 0.696049 0.580592 O\n0.818481 0.803951 0.419408 O\n0.681519 0.196049 0.919408 O\n0.181519 0.303951 0.080592 O\n0.643499 0.458469 0.164979 O\n0.143499 0.041530 0.835021 O\n0.356501 0.958469 0.335021 O\n0.856501 0.541530 0.664979 O\n0.356501 0.541530 0.835021 O\n0.856501 0.958469 0.164979 O\n0.643499 0.041530 0.664979 O\n0.818481 0.696049 0.919408 O\n0.318481 0.803951 0.080592 O\n",
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{
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"structure_string": "Mn2 Sn2 O6\n1.0\n4.765867 -0.020819 3.220363\n1.699702 4.452521 3.220363\n-0.030372 -0.020819 5.751809\nMn Sn O\n2 2 6\ndirect\n0.363712 0.363710 0.363711 Mn\n0.636290 0.636288 0.636288 Mn\n0.149838 0.149839 0.149840 Sn\n0.850163 0.850161 0.850160 Sn\n0.764980 0.445900 0.047205 O\n0.445900 0.047205 0.764980 O\n0.047206 0.764979 0.445900 O\n0.235021 0.554100 0.952793 O\n0.952795 0.235021 0.554098 O\n0.554101 0.952792 0.235020 O\n",
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{
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"structure_string": "Sm4 Zn2 Pt2 O12\n1.0\n5.842721 0.000000 0.000000\n-0.000000 4.457508 3.090971\n0.000000 0.008080 9.443554\nSm Zn Pt O\n4 2 2 12\ndirect\n0.424622 0.228667 0.749385 Sm\n0.575378 0.771333 0.250615 Sm\n0.924622 0.771333 0.750614 Sm\n0.075378 0.228667 0.249385 Sm\n0.000000 0.500000 0.500000 Zn\n0.500000 0.500000 -0.000000 Zn\n0.000000 0.000000 0.000000 Pt\n0.500000 -0.000000 0.500000 Pt\n0.808575 0.254399 0.054817 O\n0.191424 0.745601 0.945183 O\n0.800510 0.875755 0.442688 O\n0.199490 0.124245 0.557311 O\n0.300510 0.124245 0.057311 O\n0.960049 0.636629 0.248577 O\n0.460049 0.363371 0.251422 O\n0.539951 0.636629 0.748577 O\n0.691424 0.254399 0.554816 O\n0.039951 0.363371 0.751422 O\n0.699490 0.875755 0.942688 O\n0.308575 0.745601 0.445183 O\n",
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{
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"created_at": "2022-09-04T14:36:59.185481Z",
"updated_at": "2022-09-04T14:36:59.185502Z",
"structure_string": "Sr3 Mn2 O7\n1.0\n3.764384 0.000000 -0.698612\n-0.129652 3.762150 -0.698612\n-0.013150 -0.013610 10.420414\nSr Mn O\n3 2 7\ndirect\n0.499999 0.500000 0.000000 Sr\n0.316991 0.316993 0.633983 Sr\n0.683009 0.683007 0.366015 Sr\n0.097037 0.097037 0.194074 Mn\n0.902962 0.902963 0.805926 Mn\n0.904502 0.404504 0.809007 O\n0.404504 0.904504 0.809007 O\n0.095498 0.595496 0.190993 O\n0.595496 0.095496 0.190993 O\n0.807985 0.807987 0.615972 O\n0.000000 0.000000 0.000000 O\n0.192013 0.192013 0.384028 O\n",
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]
}