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{
"id": "jvasp-43419",
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"structure_string": "Li4 Sb1 Te3 O12\n1.0\n0.000000 5.050456 0.048943\n9.193612 0.000000 0.000000\n0.000000 -0.429635 -5.180252\nLi Sb Te O\n4 1 3 12\ndirect\n0.000000 0.317490 0.000000 Li\n0.500000 0.142536 0.000000 Li\n-0.000000 0.673670 0.500000 Li\n0.500000 0.843936 0.500000 Li\n0.000000 0.895799 0.000000 Sb\n0.500000 0.594670 0.000000 Te\n-0.000000 0.086201 0.500000 Te\n0.500000 0.398365 0.500000 Te\n0.778932 0.058148 0.792442 O\n0.284479 0.556116 0.650575 O\n0.212116 0.924156 0.691232 O\n0.210182 0.224784 0.701398 O\n0.789818 0.224784 0.298603 O\n0.284859 0.437203 0.147144 O\n0.715520 0.556116 0.349425 O\n0.221068 0.058148 0.207559 O\n0.715141 0.437203 0.852856 O\n0.233623 0.752718 0.191589 O\n0.787884 0.924156 0.308768 O\n0.766377 0.752718 0.808411 O\n",
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{
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"structure_string": "Na2 I2 O4 F4\n1.0\n5.092749 0.029085 0.000000\n-0.218087 5.088160 -0.000000\n0.000000 0.000000 7.274170\nNa I O F\n2 2 4 4\ndirect\n0.000000 0.000000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.465837 0.534163 0.250000 I\n0.534162 0.465838 0.750000 I\n0.311464 0.688536 0.442723 O\n0.311464 0.688536 0.057277 O\n0.688535 0.311465 0.557277 O\n0.688535 0.311465 0.942723 O\n0.825791 0.761407 0.750000 F\n0.238593 0.174209 0.750000 F\n0.761406 0.825792 0.250000 F\n0.174208 0.238594 0.250000 F\n",
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{
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"structure_string": "Sn1 H8 N2 F6\n1.0\n3.034558 -5.256008 0.000000\n3.034558 5.256008 -0.000000\n-0.000000 0.000000 4.732017\nSn H N F\n1 8 2 6\ndirect\n0.000000 0.000000 0.000000 Sn\n0.517332 0.758666 0.615977 H\n0.241335 0.482669 0.615977 H\n0.241335 0.758666 0.615977 H\n0.333333 0.666667 0.912237 H\n0.758666 0.517332 0.384024 H\n0.482669 0.241335 0.384024 H\n0.666667 0.333333 0.087763 H\n0.758666 0.241335 0.384024 H\n0.666667 0.333333 0.306237 N\n0.333333 0.666667 0.693763 N\n0.316498 0.158249 0.763694 F\n0.158249 0.841752 0.236307 F\n0.683503 0.841752 0.236307 F\n0.158249 0.316498 0.236307 F\n0.841752 0.683503 0.763694 F\n0.841752 0.158249 0.763694 F\n",
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{
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"updated_at": "2022-09-04T14:38:04.929771Z",
"structure_string": "Na2 Ca2 P6 O18\n1.0\n6.781225 0.009538 0.023793\n0.894433 6.898208 -0.014634\n1.193652 0.703371 7.512943\nNa Ca P O\n2 2 6 18\ndirect\n0.460263 0.374036 0.344763 Na\n0.539735 0.625965 0.655237 Na\n0.013890 0.723687 0.637746 Ca\n0.986108 0.276313 0.362254 Ca\n0.385431 0.883813 0.277669 P\n0.194054 0.661859 0.047843 P\n0.614567 0.116188 0.722331 P\n0.164903 0.199961 0.726902 P\n0.835095 0.800040 0.273098 P\n0.805944 0.338141 0.952157 P\n0.243517 0.651953 0.850992 O\n0.340910 0.729255 0.428422 O\n0.659089 0.270745 0.571578 O\n0.312941 0.828776 0.099947 O\n0.687058 0.171224 0.900053 O\n0.216894 0.481763 0.172318 O\n0.783104 0.518238 0.827682 O\n0.756482 0.348047 0.149008 O\n0.624084 0.863018 0.208415 O\n0.039034 0.244019 0.918478 O\n0.832558 0.619279 0.403452 O\n0.167440 0.380722 0.596548 O\n0.681078 0.906948 0.697244 O\n0.375915 0.136982 0.791585 O\n0.918410 0.962032 0.340297 O\n0.081589 0.037969 0.659703 O\n0.960964 0.755981 0.081522 O\n0.318920 0.093052 0.302756 O\n",
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{
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"created_at": "2022-09-04T14:38:06.141801Z",
"updated_at": "2022-09-04T14:38:06.141829Z",
"structure_string": "K2 Al2 Si2 O8\n1.0\n2.590678 -4.487186 -0.000000\n2.590677 4.487186 -0.000000\n-0.000000 0.000000 8.838842\nK Al Si O\n2 2 2 8\ndirect\n0.000000 0.000000 0.757774 K\n0.000000 0.000000 0.257774 K\n0.666668 0.333333 0.450648 Al\n0.333333 0.666668 0.950648 Al\n0.333333 0.666668 0.568045 Si\n0.666668 0.333333 0.068046 Si\n0.373089 0.387939 0.510065 O\n0.387939 0.014852 0.010065 O\n0.985149 0.373089 0.010065 O\n0.014852 0.626912 0.510065 O\n0.612062 0.985149 0.510065 O\n0.626912 0.612062 0.010065 O\n0.333333 0.666668 0.752738 O\n0.666668 0.333333 0.252738 O\n",
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{
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"updated_at": "2022-09-04T14:38:09.715227Z",
"structure_string": "Ba3 In2 O5 F2\n1.0\n4.156810 0.000000 -0.749624\n-0.135184 4.154611 -0.749624\n0.002761 0.002851 11.915281\nBa In O F\n3 2 5 2\ndirect\n0.500001 0.500000 0.000000 Ba\n0.676902 0.676901 0.353804 Ba\n0.323099 0.323098 0.646196 Ba\n0.908851 0.908850 0.817700 In\n0.091150 0.091150 0.182301 In\n0.103741 0.603741 0.207482 O\n0.603741 0.103741 0.207482 O\n0.000000 0.000000 0.000000 O\n0.896260 0.396259 0.792519 O\n0.396260 0.896259 0.792519 O\n0.205236 0.205235 0.410470 F\n0.794765 0.794764 0.589530 F\n",
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{
"id": "jvasp-12497",
"created_at": "2022-09-04T14:38:17.198093Z",
"updated_at": "2022-09-04T14:38:17.198107Z",
"structure_string": "Ba2 Bi1 Sb1 O6\n1.0\n5.276925 0.000000 3.032889\n1.784846 4.989484 3.001651\n-0.005776 -0.007115 6.117155\nBa Bi Sb O\n2 1 1 6\ndirect\n0.248817 0.247744 0.254621 Ba\n0.751182 0.752255 0.745379 Ba\n0.000000 0.000000 0.000000 Bi\n0.500000 0.499999 0.500000 Sb\n0.297304 0.238423 0.698383 O\n0.234110 0.761575 0.301617 O\n0.702696 0.761575 0.301617 O\n0.765889 0.238423 0.698383 O\n0.731352 0.327315 0.209979 O\n0.268647 0.672683 0.790021 O\n",
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{
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"structure_string": "Li4 Ti2 Fe4 O10\n1.0\n4.383478 -2.562450 -0.112065\n1.397713 -0.795660 4.769844\n-1.518289 -7.629441 -0.027689\nLi Ti Fe O\n4 2 4 10\ndirect\n0.200145 0.000014 0.599677 Li\n0.002734 0.999989 0.994581 Li\n0.699816 0.500018 0.600322 Li\n0.897310 0.499994 0.205416 Li\n0.099411 0.500008 0.801159 Ti\n0.800572 0.000010 0.398838 Ti\n0.304034 0.499997 0.391946 Fe\n0.490923 0.499990 0.018148 Fe\n0.595978 0.000007 0.808061 Fe\n0.409082 0.999994 0.181848 Fe\n0.949993 0.749997 0.600003 O\n0.046890 0.237965 0.397482 O\n0.344370 0.737962 0.802521 O\n0.449997 0.249996 0.599998 O\n0.125149 0.761168 0.208199 O\n0.233334 0.261175 0.991801 O\n0.853106 0.262025 0.802517 O\n0.666672 0.238821 0.208195 O\n0.555625 0.762027 0.397480 O\n0.774860 0.738825 0.991804 O\n",
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"structure_string": "V2 Fe2 H4 O10\n1.0\n5.254026 -0.009432 -0.002749\n-1.604918 5.364483 -0.039290\n-0.562001 -1.496149 6.213884\nV Fe H O\n2 2 4 10\ndirect\n0.256105 0.618542 0.757081 V\n0.743895 0.381458 0.242918 V\n0.627726 0.206121 0.692112 Fe\n0.372274 0.793878 0.307888 Fe\n0.078197 0.116071 0.701500 H\n0.921804 0.883929 0.298499 H\n0.850941 0.851077 0.705181 H\n0.149059 0.148923 0.294818 H\n0.907005 0.519565 0.730478 O\n0.092996 0.480435 0.269521 O\n0.903018 0.041124 0.749227 O\n0.365831 0.871869 0.613286 O\n0.642060 0.644410 0.347581 O\n0.398766 0.740198 0.018586 O\n0.601234 0.259802 0.981413 O\n0.096982 0.958876 0.250772 O\n0.357941 0.355590 0.652418 O\n0.634170 0.128131 0.386713 O\n",
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"structure_string": "Sm6 Cu2 Sn2 S14\n1.0\n4.971103 -8.610202 0.000000\n4.971102 8.610202 0.000000\n0.000000 0.000000 6.199829\nSm Cu Sn S\n6 2 2 14\ndirect\n0.359331 0.147194 0.768902 Sm\n0.852806 0.212137 0.768902 Sm\n0.640669 0.852806 0.268901 Sm\n0.212137 0.359331 0.268901 Sm\n0.787863 0.640669 0.768902 Sm\n0.147194 0.787863 0.268901 Sm\n0.000000 0.000000 0.177554 Cu\n0.000000 0.000000 0.677554 Cu\n0.333333 0.666667 0.836978 Sn\n0.666667 0.333333 0.336978 Sn\n0.850362 0.739874 0.205291 S\n0.666667 0.333333 0.951263 S\n0.739874 0.889512 0.705291 S\n0.333333 0.666667 0.451263 S\n0.917251 0.481160 0.512642 S\n0.082749 0.518840 0.012642 S\n0.260125 0.110488 0.205291 S\n0.889512 0.149637 0.205291 S\n0.110488 0.850362 0.705291 S\n0.518840 0.436091 0.512642 S\n0.149637 0.260125 0.705291 S\n0.436091 0.917251 0.012642 S\n0.481160 0.563909 0.012642 S\n0.563909 0.082749 0.512642 S\n",
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{
"id": "jvasp-109774",
"created_at": "2022-09-04T14:38:11.008309Z",
"updated_at": "2022-09-04T14:38:11.008336Z",
"structure_string": "Ce1 In1 Cu1 Ag1\n1.0\n4.260776 -0.000000 2.459960\n1.420259 4.017098 2.459960\n-0.000000 -0.000000 4.919920\nCe In Cu Ag\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500001 0.500000 0.500000 In\n0.250000 0.250000 0.250000 Cu\n0.750001 0.750000 0.749999 Ag\n",
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{
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"created_at": "2022-09-04T14:38:11.004336Z",
"updated_at": "2022-09-04T14:38:11.004363Z",
"structure_string": "Li2 Co2 Si4 O12\n1.0\n-5.140398 0.036958 0.016420\n-0.036515 -5.140423 0.017315\n2.461525 2.428307 9.665674\nLi Co Si O\n2 2 4 12\ndirect\n0.111163 0.142439 0.331516 Li\n0.892440 0.361159 0.831517 Li\n0.716996 0.228152 0.505910 Co\n0.978152 0.966995 0.005910 Co\n0.398936 0.016537 0.833551 Si\n0.299927 0.430034 0.661466 Si\n0.180035 0.549922 0.161465 Si\n0.766539 0.648936 0.333550 Si\n0.800658 0.348504 0.361259 O\n0.763570 0.868382 0.475753 O\n0.494976 0.656597 0.213106 O\n0.406602 0.744972 0.713108 O\n0.359451 0.298124 0.510172 O\n0.048126 0.609450 0.010172 O\n0.618379 0.013569 0.975754 O\n0.144627 0.234581 0.163013 O\n0.984585 0.394627 0.663013 O\n0.098503 0.050654 0.861258 O\n0.483107 0.274851 0.775540 O\n0.024856 0.733108 0.275540 O\n",
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]
}