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{
"id": "mp-1211065",
"created_at": "2022-09-04T14:42:47.191795Z",
"structure_string": "Mg2 Cu1 As2\n1.0\n9.960882 0.000000 0.000000\n0.000000 9.960882 0.000000\n0.000000 0.000000 31.266334\nMg Cu As\n2 1 2\ndirect\n0.500000 0.500000 0.250085 Mg\n0.500000 0.500000 0.749915 Mg\n0.500000 0.500000 0.000000 Cu\n0.500000 0.500000 0.665107 As\n0.500000 0.500000 0.334893 As\n",
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{
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{
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"formula_full": "Sr1 Li2 Ca1",
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"updated_at": "2021-11-28T01:36:07.907000Z",
"spacegroup": 71
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{
"id": "mp-1212332",
"created_at": "2022-09-04T14:39:41.880222Z",
"structure_string": "In1 Sb2\n1.0\n15.710309 0.000000 0.000000\n0.000000 16.547481 0.000000\n0.000000 0.000000 16.636454\nIn Sb\n1 2\ndirect\n0.500000 0.000000 0.500000 In\n0.500000 0.837010 0.500000 Sb\n0.500000 0.162990 0.500000 Sb\n",
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"elements": [
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"spacegroup": 47
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{
"id": "mp-1206433",
"created_at": "2022-09-04T14:39:18.201421Z",
"structure_string": "Cd1 Cl6\n1.0\n5.208224 -8.259297 0.000000\n5.208224 8.259297 0.000000\n0.000000 0.000000 45.651971\nCd Cl\n1 6\ndirect\n0.000000 0.000000 0.000000 Cd\n0.000000 0.000000 0.249987 Cl\n0.000000 0.000000 0.750013 Cl\n0.256217 0.009898 0.000000 Cl\n0.743784 0.990102 0.000000 Cl\n0.009898 0.256216 0.000000 Cl\n0.990102 0.743784 0.000000 Cl\n",
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"volume": 3927.554916915447,
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"updated_at": "2021-11-28T01:34:29.529000Z",
"spacegroup": 65
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{
"id": "mp-1211390",
"created_at": "2022-09-04T14:40:35.488599Z",
"structure_string": "Te7 As6\n1.0\n-7.019378 -12.157919 0.000000\n-6.250076 11.713762 0.000000\n0.000000 0.000000 -104.178726\nTe As\n7 6\ndirect\n-0.000000 -0.000000 0.000000 Te\n-0.000000 -0.000000 0.790310 Te\n-0.000000 -0.000000 0.209690 Te\n0.777969 0.768457 0.000000 Te\n0.222031 0.231543 -0.000000 Te\n0.009512 0.231543 0.000000 Te\n0.990488 0.768457 -0.000000 Te\n-0.000000 -0.000000 0.599549 As\n-0.000000 -0.000000 0.400451 As\n0.576331 0.588672 0.000000 As\n0.423669 0.411328 -0.000000 As\n0.987659 0.411328 0.000000 As\n0.012341 0.588672 -0.000000 As\n",
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"volume": 16482.24552958018,
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"formula_full": "Te7 As6",
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"formula_anonymous": "A6B7",
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"updated_at": "2021-11-28T01:35:03.359000Z",
"spacegroup": 65
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{
"id": "mp-1207077",
"created_at": "2022-09-04T14:44:04.185184Z",
"structure_string": "La2 Zn1 Sb3\n1.0\n13.548390 0.000000 -0.000000\n0.000000 13.548390 0.000000\n-0.000000 0.000000 47.453585\nLa Zn Sb\n2 1 3\ndirect\n0.500000 0.500000 0.247313 La\n0.500000 0.500000 0.752687 La\n0.500000 0.500000 0.500000 Zn\n0.500000 0.500000 0.695408 Sb\n0.500000 0.500000 0.304592 Sb\n0.500000 0.500000 0.000000 Sb\n",
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"volume": 8710.526515599802,
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"formula_full": "La2 Zn1 Sb3",
"formula_reduced": "La2ZnSb3",
"formula_anonymous": "AB2C3",
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{
"id": "mp-1210811",
"created_at": "2022-09-04T14:47:58.287691Z",
"structure_string": "Na9 Hg1\n1.0\n6.675720 -11.568252 0.000000\n6.675720 11.568252 0.000000\n0.000000 0.000000 32.897133\nNa Hg\n9 1\ndirect\n0.000000 0.000000 0.248294 Na\n0.000000 0.000000 0.751706 Na\n0.252157 0.996765 0.000000 Na\n0.747843 0.003235 0.000000 Na\n0.996765 0.252157 0.000000 Na\n0.003235 0.747843 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.500000 0.000000 0.000000 Na\n0.000000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 10,
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"density": 0.13317435370757058,
"density_atomic": 0.0019680951917459485,
"volume": 5081.055043444692,
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"formula_full": "Na9 Hg1",
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{
"id": "mp-1097085",
"created_at": "2022-09-04T14:40:24.763821Z",
"structure_string": "Na2 Sr1 Ca1\n1.0\n-7.244435 7.387244 10.266966\n7.244435 -7.387244 10.266966\n7.244435 7.387244 -10.266966\nNa Sr Ca\n2 1 1\ndirect\n0.754228 0.000000 0.754228 Na\n0.245772 0.000000 0.245772 Na\n0.500000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Ca\n",
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"volume": 2197.8046060522433,
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"formula_full": "Na2 Sr1 Ca1",
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{
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"structure_string": "Mo1 S6\n1.0\n4.476309 -8.301383 0.000000\n4.476309 8.301383 0.000000\n0.000000 0.000000 49.259404\nMo S\n1 6\ndirect\n0.000000 0.000000 0.000000 Mo\n0.000000 0.000000 0.250094 S\n0.000000 0.000000 0.749906 S\n0.242302 0.990945 0.000000 S\n0.757698 0.009055 0.000000 S\n0.990945 0.242302 0.000000 S\n0.009055 0.757698 0.000000 S\n",
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{
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{
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"created_at": "2022-09-04T14:45:14.022583Z",
"structure_string": "Cu7 Si6\n1.0\n-10.560747 -18.301407 -0.010399\n-10.157085 18.068171 0.002202\n-0.008412 -0.007307 -21.394130\nCu Si\n7 6\ndirect\n0.999997 0.333326 0.893923 Cu\n0.000003 0.666674 0.106077 Cu\n0.892085 0.892076 0.666657 Cu\n0.107915 0.107924 0.333343 Cu\n0.666691 0.774562 0.000002 Cu\n0.333309 0.225438 0.999998 Cu\n-0.000000 0.000000 0.000000 Cu\n0.996806 0.996809 0.666630 Si\n0.003194 0.003191 0.333370 Si\n0.666675 0.669836 0.999997 Si\n0.333325 0.330164 0.000003 Si\n0.000032 0.333362 0.994973 Si\n0.999968 0.666638 0.005027 Si\n",
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"density": 0.1263729220636388,
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"volume": 8059.216419006534,
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"formula_full": "Cu7 Si6",
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]
}