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{
"id": "mp-1073998",
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"structure_string": "Mg12 Si10\n1.0\n4.865258 0.000000 0.000000\n0.774797 5.952462 0.000000\n0.907085 1.173853 14.160739\nMg Si\n12 10\ndirect\n0.120351 0.232531 0.975833 Mg\n0.823568 0.049116 0.512611 Mg\n0.225834 0.666684 0.611004 Mg\n0.946063 0.796287 0.342051 Mg\n0.057063 0.548221 0.171343 Mg\n0.642545 0.091957 0.859339 Mg\n0.280203 0.161150 0.637868 Mg\n0.301419 0.362683 0.424718 Mg\n0.591153 0.378870 0.079159 Mg\n0.641966 0.589091 0.874840 Mg\n0.095179 0.738837 0.974888 Mg\n0.544305 0.884726 0.086826 Mg\n0.405424 0.866211 0.433294 Si\n0.743462 0.515690 0.524287 Si\n0.172969 0.853774 0.787988 Si\n0.428771 0.090499 0.261585 Si\n0.839396 0.272063 0.313886 Si\n0.738641 0.420900 0.699457 Si\n0.186747 0.432141 0.792266 Si\n0.510931 0.625764 0.268778 Si\n0.992397 0.072477 0.167034 Si\n0.715049 0.846658 0.697355 Si\n",
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{
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"structure_string": "Mn2 P2\n1.0\n1.669674 -2.891961 0.000000\n1.669674 2.891961 0.000000\n0.000000 0.000000 5.369199\nMn P\n2 2\ndirect\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.333333 0.666667 0.250000 P\n0.666667 0.333333 0.750000 P\n",
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},
{
"id": "mp-1061865",
"created_at": "2022-09-04T14:47:15.422524Z",
"structure_string": "Te1 N2\n1.0\n0.000000 2.639461 2.639461\n2.639461 0.000000 2.639461\n2.639461 2.639461 0.000000\nTe N\n1 2\ndirect\n0.000000 0.000000 0.000000 Te\n0.750000 0.750000 0.750000 N\n0.250000 0.250000 0.250000 N\n",
"nsites": 3,
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"elements": [
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],
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"density": 7.026197373738366,
"density_atomic": 0.08157282651780083,
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"updated_at": "2021-11-28T01:38:01.464000Z",
"spacegroup": 225
},
{
"id": "mp-1094909",
"created_at": "2022-09-04T14:47:15.219491Z",
"structure_string": "Mg4 Cd2\n1.0\n1.607080 -8.068170 0.000000\n1.607080 8.068170 0.000000\n0.000000 0.000000 5.085269\nMg Cd\n4 2\ndirect\n0.444570 0.555430 0.250000 Mg\n0.776781 0.223219 0.250000 Mg\n0.223219 0.776781 0.750000 Mg\n0.555430 0.444570 0.750000 Mg\n0.111800 0.888200 0.250000 Cd\n0.888200 0.111800 0.750000 Cd\n",
"nsites": 6,
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"elements": [
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"chemical_system": "Cd-Mg",
"density": 4.055133431911637,
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"spacegroup": 63
},
{
"id": "mp-637308",
"created_at": "2022-09-04T14:47:15.154238Z",
"structure_string": "Ce10 Sn6\n1.0\n-6.214077 6.214077 3.052016\n6.214077 -6.214077 3.052016\n6.214077 6.214077 -3.052016\nCe Sn\n10 6\ndirect\n0.416835 0.278509 0.695344 Ce\n0.083165 0.778509 0.861674 Ce\n0.778509 0.916835 0.695344 Ce\n0.221491 0.083165 0.304656 Ce\n0.916835 0.221491 0.138326 Ce\n0.250000 0.750000 0.500000 Ce\n0.278509 0.583165 0.861674 Ce\n0.721491 0.416835 0.138326 Ce\n0.583165 0.721491 0.304656 Ce\n0.750000 0.250000 0.500000 Ce\n0.660457 0.160457 0.820914 Sn\n0.839543 0.660457 0.500000 Sn\n0.750000 0.750000 0.000000 Sn\n0.160457 0.339543 0.500000 Sn\n0.339543 0.839543 0.179086 Sn\n0.250000 0.250000 0.000000 Sn\n",
"nsites": 16,
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],
"chemical_system": "Ce-Sn",
"density": 7.444488309994804,
"density_atomic": 0.03394063196483889,
"volume": 471.4113755034187,
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"formula_full": "Ce10 Sn6",
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"energy": -91.90480178,
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"updated_at": "2021-11-28T01:37:56.972000Z",
"spacegroup": 140
},
{
"id": "mp-1195853",
"created_at": "2022-09-04T14:47:18.697114Z",
"structure_string": "La8 Ir28\n1.0\n2.699292 -4.675312 0.000000\n2.699292 4.675312 0.000000\n0.000000 0.000000 26.563353\nLa Ir\n8 28\ndirect\n0.333333 0.666667 0.471078 La\n0.666667 0.333333 0.528922 La\n0.666667 0.333333 0.971078 La\n0.333333 0.666667 0.028922 La\n0.333333 0.666667 0.325508 La\n0.666667 0.333333 0.674492 La\n0.666667 0.333333 0.825508 La\n0.333333 0.666667 0.174492 La\n0.000000 0.000000 0.500000 Ir\n0.000000 0.000000 0.000000 Ir\n0.832194 0.167806 0.250000 Ir\n0.832194 0.664388 0.250000 Ir\n0.335612 0.167806 0.250000 Ir\n0.167806 0.832194 0.750000 Ir\n0.167806 0.335612 0.750000 Ir\n0.664388 0.832194 0.750000 Ir\n0.834336 0.165664 0.412934 Ir\n0.834336 0.668673 0.412934 Ir\n0.331327 0.165664 0.412934 Ir\n0.165664 0.834336 0.587066 Ir\n0.165664 0.331327 0.587066 Ir\n0.668673 0.834336 0.587066 Ir\n0.165664 0.834336 0.912934 Ir\n0.165664 0.331327 0.912934 Ir\n0.668673 0.834336 0.912934 Ir\n0.834336 0.165664 0.087066 Ir\n0.834336 0.668673 0.087066 Ir\n0.331327 0.165664 0.087066 Ir\n0.000000 0.000000 0.331814 Ir\n0.000000 0.000000 0.668186 Ir\n0.000000 0.000000 0.831814 Ir\n0.000000 0.000000 0.168186 Ir\n0.333333 0.666667 0.666624 Ir\n0.666667 0.333333 0.333376 Ir\n0.666667 0.333333 0.166624 Ir\n0.333333 0.666667 0.833376 Ir\n",
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"elements": [
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"formula_full": "La8 Ir28",
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{
"id": "mp-776402",
"created_at": "2022-09-04T14:47:19.156502Z",
"structure_string": "B80 H104\n1.0\n10.729184 0.000000 0.000000\n0.000000 10.861153 0.000000\n0.000000 0.000000 14.805902\nB H\n80 104\ndirect\n0.931981 0.991259 0.343551 B\n0.568019 0.991259 0.843551 B\n0.773425 0.986234 0.315296 B\n0.726575 0.986234 0.815296 B\n0.684325 0.976119 0.416562 B\n0.815675 0.976119 0.916562 B\n0.947847 0.966652 0.462673 B\n0.552153 0.966652 0.962673 B\n0.705195 0.943565 0.003168 B\n0.794805 0.943565 0.503168 B\n0.322064 0.943063 0.081559 B\n0.177936 0.943063 0.581559 B\n0.500313 0.852926 0.883156 B\n0.999687 0.852926 0.383156 B\n0.891250 0.851988 0.291722 B\n0.608750 0.851988 0.791722 B\n0.911808 0.809597 0.479870 B\n0.588192 0.809597 0.979870 B\n0.395701 0.767303 0.374001 B\n0.104299 0.767303 0.874001 B\n0.895701 0.732697 0.374001 B\n0.604299 0.732697 0.874001 B\n0.411808 0.690403 0.479870 B\n0.088192 0.690403 0.979870 B\n0.391250 0.648012 0.291722 B\n0.108750 0.648012 0.791722 B\n0.000313 0.647074 0.883156 B\n0.499687 0.647074 0.383156 B\n0.822064 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},
{
"id": "mp-11419",
"created_at": "2022-09-04T14:47:18.704312Z",
"structure_string": "Th1 Ga2\n1.0\n2.140597 -3.707623 0.000000\n2.140597 3.707623 0.000000\n0.000000 0.000000 4.244329\nTh Ga\n1 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.333333 0.666667 0.500000 Ga\n0.666667 0.333333 0.500000 Ga\n",
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