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"id": "jvasp-86679",
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"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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{
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"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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{
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"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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"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": "2022-09-04T14:37:15.128279Z",
"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": "2022-09-04T14:36:10.841829Z",
"updated_at": "2022-09-04T14:36:10.841856Z",
"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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"formula_full": "Sr4 H8 O8",
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{
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"created_at": "2022-09-04T14:37:02.136210Z",
"updated_at": "2022-09-04T14:37:02.136224Z",
"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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{
"id": "jvasp-78803",
"created_at": "2022-09-04T14:37:09.819052Z",
"updated_at": "2022-09-04T14:37:09.819075Z",
"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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"created_at": "2022-09-04T14:35:54.245133Z",
"updated_at": "2022-09-04T14:35:54.245143Z",
"structure_string": "Na1 Zr2 Ti1 F11\n1.0\n5.365721 0.010567 2.038666\n1.007227 5.270347 2.038666\n0.001259 0.001043 7.854119\nNa Zr Ti F\n1 2 1 11\ndirect\n0.000000 0.000000 0.000000 Na\n0.503148 0.503148 0.766542 Zr\n0.496852 0.496853 0.233458 Zr\n0.000000 -0.000000 0.500000 Ti\n0.808615 0.216991 0.690446 F\n0.783009 0.191385 0.309554 F\n0.191385 0.783009 0.309554 F\n0.216992 0.808615 0.690446 F\n0.500000 0.500000 0.500000 F\n0.328505 0.671496 0.000000 F\n0.671495 0.328505 0.000000 F\n0.247652 0.247652 0.356407 F\n0.752348 0.752348 0.643593 F\n0.263686 0.263685 0.892056 F\n0.736315 0.736316 0.107945 F\n",
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{
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"structure_string": "Ti8 O16\n1.0\n5.183224 0.000000 0.000000\n-0.000000 5.987273 0.000000\n0.000000 0.000000 9.887576\nTi O\n8 16\ndirect\n0.493252 0.750000 0.486338 Ti\n0.493252 0.750000 0.013662 Ti\n0.506747 0.250000 0.513662 Ti\n0.506747 0.250000 0.986338 Ti\n0.000000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.000000 0.500000 0.000000 Ti\n0.333056 0.001059 0.098236 O\n0.333056 0.498941 0.401764 O\n0.333056 0.498941 0.098236 O\n0.333056 0.001059 0.401764 O\n0.666944 0.998940 0.901764 O\n0.666944 0.501059 0.598236 O\n0.832951 0.250000 0.095611 O\n0.166598 0.250000 0.900484 O\n0.167048 0.750000 0.904389 O\n0.167048 0.750000 0.595611 O\n0.666944 0.998940 0.598236 O\n0.166598 0.250000 0.599517 O\n0.833401 0.750000 0.099517 O\n0.833401 0.750000 0.400483 O\n0.832951 0.250000 0.404389 O\n0.666944 0.501059 0.901764 O\n",
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{
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}