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{
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{
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"structure_string": "Sm12 Si8 S34\n1.0\n8.938018 0.000000 0.000000\n0.175185 9.889801 0.000000\n0.658239 1.953006 14.028652\nSm Si S\n12 8 34\ndirect\n0.912840 0.918931 0.834494 Sm\n0.664590 0.591150 0.657681 Sm\n0.087160 0.081069 0.165506 Sm\n0.012061 0.766465 0.463802 Sm\n0.363610 0.060514 0.678276 Sm\n0.449967 0.737619 0.002024 Sm\n0.105934 0.383896 0.814195 Sm\n0.636390 0.939486 0.321724 Sm\n0.987939 0.233535 0.536198 Sm\n0.550033 0.262381 0.997976 Sm\n0.894066 0.616104 0.185805 Sm\n0.335410 0.408850 0.342319 Sm\n0.767970 0.560522 0.900552 Si\n0.248433 0.059240 0.922564 Si\n0.232030 0.439478 0.099448 Si\n0.720617 0.943913 0.607270 Si\n0.750005 0.499478 0.416429 Si\n0.249995 0.500522 0.583571 Si\n0.751567 0.940760 0.077436 Si\n0.279383 0.056087 0.392730 Si\n0.487527 0.153884 0.397464 S\n0.700140 0.695093 0.458943 S\n0.697125 0.365547 0.541741 S\n0.658870 0.000500 0.942406 S\n0.991321 0.625639 0.883452 S\n0.109473 0.202693 0.343117 S\n0.008679 0.374361 0.116548 S\n0.985899 0.508995 0.377383 S\n0.644769 0.467090 0.291929 S\n0.341130 0.999500 0.057594 S\n0.322072 0.483021 0.955718 S\n0.816411 0.021261 0.468786 S\n0.686407 0.087476 0.702604 S\n0.749237 0.383691 0.830660 S\n0.370252 0.280007 0.166537 S\n0.744862 0.118835 0.149070 S\n0.512473 0.846116 0.602536 S\n0.677928 0.516979 0.044282 S\n0.299860 0.304907 0.541057 S\n0.937336 0.858598 0.279746 S\n0.038070 0.151007 0.952113 S\n0.620004 0.786208 0.162428 S\n0.961930 0.848993 0.047887 S\n0.250763 0.616309 0.169340 S\n0.014101 0.491005 0.622617 S\n0.629748 0.719993 0.833463 S\n0.255138 0.881165 0.850930 S\n0.379996 0.213792 0.837572 S\n0.313593 0.912524 0.297396 S\n0.890527 0.797307 0.656883 S\n0.355231 0.532910 0.708071 S\n0.183589 0.978739 0.531214 S\n0.062664 0.141402 0.720254 S\n0.302875 0.634453 0.458259 S\n",
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"formula_full": "Sm12 Si8 S34",
"formula_reduced": "Sm6Si4S17",
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"updated_at": "2021-11-28T01:36:43.194000Z",
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},
{
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],
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"density_atomic": 0.11559457424259252,
"volume": 69.20740054122957,
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"formula_full": "Fe2 H2 O4",
"formula_reduced": "FeHO2",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:36:47.328000Z",
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},
{
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"created_at": "2022-09-04T14:44:30.586566Z",
"structure_string": "Ba2 U1 Mn1 O6\n1.0\n0.000000 4.287707 4.287707\n4.287707 0.000000 4.287707\n4.287707 4.287707 0.000000\nBa U Mn O\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 U\n0.500000 0.500000 0.500000 Mn\n0.755641 0.755641 0.244359 O\n0.755641 0.244359 0.755641 O\n0.244359 0.755641 0.244359 O\n0.755641 0.244359 0.244359 O\n0.244359 0.244359 0.755641 O\n0.244359 0.755641 0.755641 O\n",
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"formula_full": "Ba2 U1 Mn1 O6",
"formula_reduced": "Ba2UMnO6",
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"updated_at": "2021-11-28T01:36:42.753000Z",
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}
]
}