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{
"id": "jvasp-62144",
"created_at": "2022-09-04T14:35:49.200090Z",
"updated_at": "2022-09-04T14:35:49.200109Z",
"structure_string": "P4 Au4 Cl32\n1.0\n-5.663533 6.046486 7.976217\n5.663533 -6.046486 7.976217\n5.663533 6.046486 -7.976217\nP Au Cl\n4 4 32\ndirect\n0.749860 0.749860 -0.000000 P\n0.250141 0.250141 -0.000000 P\n0.249859 0.749859 0.500000 P\n0.750141 0.250141 0.500000 P\n0.250000 0.325616 0.575617 Au\n0.750000 0.674383 0.424383 Au\n0.250000 0.835338 0.085338 Au\n0.750001 0.164662 0.914662 Au\n0.223093 0.414148 0.992523 Cl\n0.441957 0.323537 0.765494 Cl\n0.558043 0.676463 0.234506 Cl\n0.941957 0.676463 0.618420 Cl\n0.105163 0.690752 0.085589 Cl\n0.394837 0.980426 0.085589 Cl\n0.894837 0.309247 0.914411 Cl\n0.605164 0.019574 0.914411 Cl\n0.250000 0.629876 0.879876 Cl\n0.750000 0.370124 0.120124 Cl\n0.250000 0.039605 0.289605 Cl\n0.750000 0.960395 0.710395 Cl\n0.058043 0.323537 0.381580 Cl\n0.604983 0.529466 0.424484 Cl\n0.895018 0.819502 0.424484 Cl\n0.395018 0.470534 0.575516 Cl\n0.421626 0.230570 0.007477 Cl\n0.078374 0.585852 0.308944 Cl\n0.723093 0.230570 0.308945 Cl\n0.776907 0.585852 0.007477 Cl\n0.578374 0.769430 0.992523 Cl\n0.921627 0.414148 0.691056 Cl\n0.276907 0.769430 0.691055 Cl\n0.238438 0.931384 0.526653 Cl\n0.095269 0.068615 0.807054 Cl\n0.404731 0.711784 0.473346 Cl\n0.761562 0.068616 0.473347 Cl\n0.738439 0.711784 0.807054 Cl\n0.904731 0.931385 0.192946 Cl\n0.104983 0.180497 0.575516 Cl\n0.261562 0.288215 0.192946 Cl\n0.595270 0.288215 0.526654 Cl\n",
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{
"id": "jvasp-97704",
"created_at": "2022-09-04T14:35:49.196797Z",
"updated_at": "2022-09-04T14:35:49.196822Z",
"structure_string": "Ba12 Mn10 O32\n1.0\n5.738801 0.000000 0.000000\n-2.869401 6.638510 -0.000000\n0.000000 -0.000000 20.099536\nBa Mn O\n12 10 32\ndirect\n0.121408 0.242815 0.839358 Ba\n0.645685 0.291370 0.981266 Ba\n0.354315 0.708630 0.018734 Ba\n0.854315 0.708630 0.481266 Ba\n0.145685 0.291370 0.518734 Ba\n0.914174 0.828347 0.678509 Ba\n0.878592 0.757185 0.160642 Ba\n0.585826 0.171653 0.178509 Ba\n0.414174 0.828347 0.821491 Ba\n0.621408 0.242815 0.660642 Ba\n0.378592 0.757185 0.339358 Ba\n0.085826 0.171653 0.321491 Ba\n0.877200 0.754401 0.906291 Mn\n0.122800 0.245599 0.093709 Mn\n0.622800 0.245599 0.406291 Mn\n0.377200 0.754401 0.593709 Mn\n0.000000 0.000000 0.000000 Mn\n0.749881 0.499762 0.811126 Mn\n0.750119 0.500238 0.311126 Mn\n0.249881 0.499762 0.688874 Mn\n0.500000 0.000000 0.500000 Mn\n0.250119 0.500238 0.188874 Mn\n0.884975 0.769950 0.314149 O\n0.588092 0.176185 0.316016 O\n0.411908 0.823815 0.683984 O\n0.615025 0.230050 0.814149 O\n0.384975 0.769950 0.185851 O\n0.943005 0.450996 0.385331 O\n0.987689 0.475379 0.250000 O\n0.492009 0.549004 0.614669 O\n0.556995 0.549004 0.885331 O\n0.007991 0.450996 0.114669 O\n0.056995 0.549004 0.614669 O\n0.507991 0.450996 0.385331 O\n0.443005 0.450996 0.114669 O\n0.992009 0.549004 0.885331 O\n0.794324 0.037586 0.069274 O\n0.756738 0.962414 0.930726 O\n0.705676 0.962414 0.569274 O\n0.743262 0.037586 0.430726 O\n0.205676 0.962414 0.930726 O\n0.243262 0.037586 0.069274 O\n0.294324 0.037586 0.430726 O\n0.256738 0.962414 0.569274 O\n0.855096 0.710193 0.002516 O\n0.144904 0.289807 -0.002516 O\n0.644904 0.289807 0.502516 O\n0.355096 0.710193 0.497484 O\n0.911908 0.823815 0.816017 O\n0.088092 0.176185 0.183984 O\n0.012311 0.524621 0.750000 O\n0.487689 0.475379 0.250000 O\n0.512311 0.524621 0.750000 O\n0.115025 0.230050 0.685851 O\n",
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{
"id": "jvasp-69757",
"created_at": "2022-09-04T14:35:49.190503Z",
"updated_at": "2022-09-04T14:35:49.190531Z",
"structure_string": "Y1 Be1 Fe1\n1.0\n1.916700 -3.319822 0.000000\n1.916700 3.319822 -0.000000\n0.000000 0.000000 3.849892\nY Be Fe\n1 1 1\ndirect\n0.333333 0.666667 0.333319 Y\n0.000000 0.000000 0.833329 Be\n0.666667 0.333333 0.833351 Fe\n",
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{
"id": "jvasp-105853",
"created_at": "2022-09-04T14:35:49.189864Z",
"updated_at": "2022-09-04T14:35:49.189883Z",
"structure_string": "Sr1 Yb1\n1.0\n4.017396 0.000000 -0.000000\n-2.008699 3.479166 -0.000000\n-0.000000 0.000000 6.541321\nYb Sr\n1 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.333333 0.666668 0.500000 Sr\n",
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{
"id": "jvasp-63916",
"created_at": "2022-09-04T14:35:49.189200Z",
"updated_at": "2022-09-04T14:35:49.189218Z",
"structure_string": "Ba4 Ta1 Be1\n1.0\n0.000000 4.891465 4.891465\n4.891465 0.000000 4.891465\n4.891465 4.891465 -0.000000\nBa Ta Be\n4 1 1\ndirect\n0.124739 0.625087 0.625087 Ba\n0.625087 0.625087 0.625087 Ba\n0.625087 0.124739 0.625087 Ba\n0.625087 0.625087 0.124739 Ba\n0.000000 0.000000 0.000000 Ta\n0.250000 0.250000 0.250000 Be\n",
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{
"id": "jvasp-91629",
"created_at": "2022-09-04T14:35:49.181565Z",
"updated_at": "2022-09-04T14:35:49.181583Z",
"structure_string": "Li2 Pr2 Sn4\n1.0\n-4.540780 0.000000 0.000000\n0.000000 -0.000000 -4.536187\n2.270390 -9.562340 -0.000000\nLi Pr Sn\n2 2 4\ndirect\n0.675817 0.750000 0.351632 Li\n0.324183 0.250000 0.648367 Li\n0.893650 0.750000 0.787299 Pr\n0.106350 0.250000 0.212701 Pr\n0.544694 0.750000 0.089389 Sn\n0.455305 0.250000 0.910611 Sn\n0.250122 0.750000 0.500245 Sn\n0.749877 0.250000 0.499755 Sn\n",
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"formula_full": "Li2 Pr2 Sn4",
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{
"id": "jvasp-90208",
"created_at": "2022-09-04T14:35:49.181350Z",
"updated_at": "2022-09-04T14:35:49.181381Z",
"structure_string": "Er6 Mn1 Te2\n1.0\n0.000000 0.000000 -3.994996\n-4.082046 -7.070312 0.000000\n-4.082458 7.070549 0.000000\nEr Mn Te\n6 1 2\ndirect\n0.500000 0.611173 0.000000 Er\n0.500000 0.388851 0.388860 Er\n0.500000 -0.000008 0.611141 Er\n0.000000 0.233215 0.000000 Er\n0.000000 0.766729 0.766701 Er\n0.000000 0.000028 0.233299 Er\n0.500000 0.999911 0.000001 Mn\n0.000000 0.333355 0.666709 Te\n0.000000 0.666647 0.333292 Te\n",
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"formula_full": "Er6 Mn1 Te2",
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"updated_at": "2022-09-04T14:35:49.179647Z",
"structure_string": "In1 Pd5 Se1\n1.0\n4.070652 -0.000000 -0.000000\n-0.000000 4.070652 0.000000\n-0.000000 -0.000000 7.175821\nIn Pd Se\n1 5 1\ndirect\n0.500000 0.500000 0.000000 In\n0.000000 0.000000 0.000000 Pd\n0.500000 0.000000 0.722010 Pd\n0.000000 0.500000 0.722010 Pd\n0.500000 0.000000 0.277990 Pd\n0.000000 0.500000 0.277990 Pd\n0.000000 0.000000 0.500000 Se\n",
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],
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{
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"created_at": "2022-09-04T14:35:49.165653Z",
"updated_at": "2022-09-04T14:35:49.165684Z",
"structure_string": "Zr1 Be1 Mo1\n1.0\n-1.386682 1.386682 6.050012\n1.386682 -1.386682 6.050012\n1.386682 1.386682 -6.050012\nZr Be Mo\n1 1 1\ndirect\n0.650922 0.650922 0.000000 Zr\n0.991281 0.991281 0.000000 Be\n0.357796 0.357796 0.000000 Mo\n",
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{
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"updated_at": "2022-09-04T14:35:49.165646Z",
"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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"updated_at": "2022-09-04T14:35:49.164943Z",
"structure_string": "Ba4 Zr1 Sn1\n1.0\n-0.000000 4.984289 4.984289\n4.984289 0.000000 4.984289\n4.984289 4.984289 -0.000000\nBa Zr Sn\n4 1 1\ndirect\n0.126697 0.624435 0.624435 Ba\n0.624435 0.624435 0.624435 Ba\n0.624435 0.126697 0.624435 Ba\n0.624435 0.624435 0.126697 Ba\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Sn\n",
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{
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"created_at": "2022-09-04T14:35:49.163276Z",
"updated_at": "2022-09-04T14:35:49.163311Z",
"structure_string": "Be1 Nb1 Rh1\n1.0\n-1.438711 1.438711 4.860851\n1.438711 -1.438711 4.860851\n1.438711 1.438711 -4.860851\nBe Nb Rh\n1 1 1\ndirect\n0.022918 0.022918 0.000000 Be\n0.338215 0.338215 0.000000 Nb\n0.638866 0.638866 0.000000 Rh\n",
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]
}