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"id": "jvasp-78803",
"created_at": "2022-09-04T14:37:09.819052Z",
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"structure_string": "Mg3 Cd1\n1.0\n3.222757 -0.000000 0.000000\n-1.611378 2.790989 -0.000000\n-0.000000 0.000000 9.892470\nMg Cd\n3 1\ndirect\n0.666668 0.333333 0.000000 Mg\n0.000000 0.000000 0.743123 Mg\n0.000000 0.000000 0.256877 Mg\n0.666668 0.333333 0.500000 Cd\n",
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{
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"structure_string": "Al8 O12\n1.0\n0.000000 3.187565 -0.020460\n12.127537 0.000000 0.000000\n0.000000 -1.444322 -5.055851\nAl O\n8 12\ndirect\n0.580900 0.166030 0.158352 Al\n0.819928 0.433218 0.179000 Al\n0.180073 0.933218 0.321000 Al\n0.419102 0.666030 0.341648 Al\n0.580900 0.333970 0.658351 Al\n0.819929 0.066782 0.679000 Al\n0.180074 0.566782 0.820999 Al\n0.419102 0.833970 0.841648 Al\n0.327123 -0.007790 0.690151 O\n0.672879 0.492210 0.809848 O\n0.018803 0.373663 0.506591 O\n0.596545 0.194292 0.505610 O\n0.403457 0.805708 0.494390 O\n0.596545 0.305708 0.005610 O\n0.327123 0.507790 0.190151 O\n0.672879 0.007790 0.309848 O\n0.403457 0.694293 0.994389 O\n0.018802 0.126337 0.006591 O\n0.981199 0.626337 0.493408 O\n0.981200 0.873663 0.993408 O\n",
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{
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"structure_string": "Sr4 H8 O8\n1.0\n9.881477 0.000000 0.000000\n0.000000 6.041737 0.000000\n0.000000 0.000000 3.912510\nSr H O\n4 8 8\ndirect\n0.658084 0.397896 0.250000 Sr\n0.158084 0.102104 0.250000 Sr\n0.338685 0.602125 0.750000 Sr\n0.838685 0.897876 0.750000 Sr\n0.523761 0.128443 0.750000 H\n0.023761 0.371557 0.750000 H\n0.972994 0.628503 0.250000 H\n0.472994 0.871498 0.250000 H\n0.090412 0.684044 0.750000 H\n0.406362 0.184078 0.250000 H\n0.906363 0.315922 0.250000 H\n0.590412 0.815957 0.750000 H\n0.122714 0.373912 0.750000 O\n0.892325 0.154038 0.250000 O\n0.392325 0.345962 0.250000 O\n0.104434 0.845930 0.750000 O\n0.604434 0.654071 0.750000 O\n0.874041 0.626055 0.250000 O\n0.374041 0.873946 0.250000 O\n0.622714 0.126088 0.750000 O\n",
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{
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"updated_at": "2022-09-04T14:37:15.128306Z",
"structure_string": "Y1 Co1 F5\n1.0\n3.922454 -0.000000 1.442447\n1.642095 5.239856 1.589040\n0.124792 -0.015328 5.715050\nY Co F\n1 1 5\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Co\n0.500000 0.817873 0.182128 F\n0.499999 0.182128 0.817872 F\n0.770489 0.229511 0.229511 F\n0.229511 0.770490 0.770490 F\n0.000000 0.500000 0.500000 F\n",
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{
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"created_at": "2022-09-04T14:37:09.730336Z",
"updated_at": "2022-09-04T14:37:09.730365Z",
"structure_string": "Y1 Co1 F5\n1.0\n3.922454 -0.000000 1.442447\n1.642095 5.239856 1.589040\n0.124792 -0.015328 5.715050\nY Co F\n1 1 5\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Co\n0.500000 0.817873 0.182128 F\n0.499999 0.182128 0.817872 F\n0.770489 0.229511 0.229511 F\n0.229511 0.770490 0.770490 F\n0.000000 0.500000 0.500000 F\n",
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{
"id": "jvasp-91557",
"created_at": "2022-09-04T14:36:04.373484Z",
"updated_at": "2022-09-04T14:36:04.373511Z",
"structure_string": "K4 Cd2 Sn2\n1.0\n-6.466182 0.000000 0.000000\n0.000000 -4.255238 -5.396599\n0.000000 -4.255238 5.396599\nK Cd Sn\n4 2 2\ndirect\n0.250000 0.685520 0.023209 K\n0.750000 0.976792 0.314481 K\n0.250000 0.033213 0.675596 K\n0.750000 0.324404 0.966787 K\n0.500000 0.505071 0.494929 Cd\n0.000000 0.505071 0.494929 Cd\n0.250000 0.233844 0.223914 Sn\n0.750000 0.776086 0.766157 Sn\n",
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{
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"updated_at": "2022-09-04T14:36:46.297397Z",
"structure_string": "Li4 Mn4 F12\n1.0\n5.230421 0.000000 0.000000\n0.000000 5.220419 0.000000\n0.000000 0.000000 8.359539\nLi Mn F\n4 4 12\ndirect\n0.483413 0.863413 0.002073 Li\n0.983413 0.363413 0.497927 Li\n0.483413 0.636587 0.502073 Li\n0.983413 0.136587 0.997927 Li\n0.450321 0.353505 0.175492 Mn\n0.950321 0.853505 0.324508 Mn\n0.450321 0.146495 0.675493 Mn\n0.950321 0.646495 0.824508 Mn\n0.728211 0.994148 0.837667 F\n0.228211 0.494148 0.662334 F\n0.724394 0.454841 0.651092 F\n0.646933 0.953457 0.493350 F\n0.146933 0.046543 0.506650 F\n0.724394 0.045159 0.151092 F\n0.728211 0.505852 0.337667 F\n0.228211 0.005852 0.162334 F\n0.224394 0.954841 0.848908 F\n0.646933 0.546543 -0.006650 F\n0.224394 0.545159 0.348908 F\n0.146933 0.453457 0.006650 F\n",
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"formula_full": "Li4 Mn4 F12",
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{
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"created_at": "2022-09-04T14:35:55.787542Z",
"updated_at": "2022-09-04T14:35:55.787562Z",
"structure_string": "K4 Ga6\n1.0\n5.749277 -0.000000 -2.200651\n-0.842343 5.687236 -2.200651\n-0.049209 -0.057034 8.481860\nK Ga\n4 6\ndirect\n0.390427 0.390427 0.780854 K\n0.250001 0.750001 0.500000 K\n0.609574 0.609574 0.219147 K\n0.750000 0.250001 0.500000 K\n0.000000 0.294801 0.000000 Ga\n0.143250 0.143250 0.286499 Ga\n0.294801 0.000000 0.000000 Ga\n0.000000 0.705199 0.000000 Ga\n0.856751 0.856751 0.713501 Ga\n0.705199 0.000000 0.000000 Ga\n",
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{
"id": "jvasp-56211",
"created_at": "2022-09-04T14:37:29.725000Z",
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"structure_string": "K2 Sr1 Nb6 Cl18\n1.0\n8.296865 -0.002553 5.939972\n3.051348 7.715389 5.939973\n-0.003757 -0.002553 10.203981\nK Sr Nb Cl\n2 1 6 18\ndirect\n0.221447 0.221447 0.221447 K\n0.778552 0.778554 0.778553 K\n0.499999 0.500000 0.500000 Sr\n0.148689 0.787658 0.925556 Nb\n0.074444 0.851310 0.212342 Nb\n0.851310 0.212343 0.074444 Nb\n0.212342 0.074444 0.851310 Nb\n0.787657 0.925556 0.148689 Nb\n0.925555 0.148691 0.787658 Nb\n0.841758 0.334278 0.512272 Cl\n0.337624 0.915445 0.076406 Cl\n0.575273 0.161815 0.263393 Cl\n0.334276 0.512273 0.841759 Cl\n0.915443 0.076407 0.337624 Cl\n0.424726 0.838186 0.736606 Cl\n0.161814 0.263394 0.575274 Cl\n0.736606 0.424727 0.838185 Cl\n0.263393 0.575274 0.161814 Cl\n0.158241 0.665723 0.487727 Cl\n0.662375 0.084556 0.923594 Cl\n0.512272 0.841760 0.334277 Cl\n0.923593 0.662376 0.084555 Cl\n0.076406 0.337625 0.915444 Cl\n0.084555 0.923594 0.662375 Cl\n0.487727 0.158241 0.665723 Cl\n0.838185 0.736607 0.424726 Cl\n0.665722 0.487728 0.158241 Cl\n",
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{
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"structure_string": "K4 Ga6\n1.0\n5.749257 -0.000000 -2.200643\n-0.842340 5.687215 -2.200643\n-0.049207 -0.057032 8.481834\nK Ga\n4 6\ndirect\n0.390426 0.390426 0.780853 K\n0.250000 0.750000 0.500000 K\n0.609574 0.609573 0.219147 K\n0.750000 0.250000 0.500000 K\n-0.000000 0.294802 0.000000 Ga\n0.143250 0.143250 0.286498 Ga\n0.294802 0.000000 0.000000 Ga\n-0.000000 0.705197 0.000000 Ga\n0.856750 0.856750 0.713501 Ga\n0.705198 0.000000 0.000000 Ga\n",
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{
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}