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{
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{
"id": "mp-1220353",
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"structure_string": "Nd2 Ag2 Pb2\n1.0\n-2.495302 -4.281143 -0.036656\n-2.495302 4.281143 0.036656\n0.000000 -0.069382 -8.055407\nNd Ag Pb\n2 2 2\ndirect\n0.999337 0.000663 0.782136 Nd\n0.000663 0.999337 0.217864 Nd\n0.666740 0.333260 0.990753 Ag\n0.333260 0.666740 0.009247 Ag\n0.330568 0.669432 0.428461 Pb\n0.669432 0.330568 0.571539 Pb\n",
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{
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{
"id": "mp-1094627",
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"structure_string": "Mg3 Ga3\n1.0\n1.535958 -2.660356 0.000000\n1.535958 2.660356 0.000000\n0.000000 0.000000 15.320364\nMg Ga\n3 3\ndirect\n0.666667 0.333333 0.673604 Mg\n0.000000 0.000000 0.500000 Mg\n0.666667 0.333333 0.326396 Mg\n0.666667 0.333333 0.000000 Ga\n0.000000 0.000000 0.832450 Ga\n0.000000 0.000000 0.167550 Ga\n",
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"volume": 125.20399203332973,
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"formula_full": "Mg3 Ga3",
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"spacegroup": 187
},
{
"id": "mp-1224554",
"created_at": "2022-09-04T14:46:22.232008Z",
"structure_string": "Gd1 U1 Al4\n1.0\n-3.917705 0.000000 -3.917705\n3.917705 -3.917705 0.000000\n-3.917705 -3.917705 0.000000\nGd U Al\n1 1 4\ndirect\n0.500000 0.750000 0.750000 Gd\n0.000000 0.000000 0.000000 U\n0.748998 0.374499 0.876503 Al\n0.251002 0.374499 0.374499 Al\n0.251002 0.876503 0.374499 Al\n0.748998 0.374499 0.374499 Al\n",
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"formula_full": "Gd1 U1 Al4",
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"spacegroup": 216
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{
"id": "mp-1185887",
"created_at": "2022-09-04T14:46:13.005342Z",
"structure_string": "Mg1 Hg5\n1.0\n3.037677 -5.261411 0.000000\n3.037677 5.261411 0.000000\n0.000000 0.000000 4.856729\nMg Hg\n1 5\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.689762 0.500000 Hg\n0.689762 0.000000 0.500000 Hg\n0.310238 0.310238 0.500000 Hg\n0.666667 0.333333 0.000000 Hg\n0.333333 0.666667 0.000000 Hg\n",
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},
{
"id": "mp-1226800",
"created_at": "2022-09-04T14:46:19.620890Z",
"structure_string": "Ce2 Cu2 Ni2\n1.0\n-4.128774 0.000000 0.000000\n-2.064387 -2.987424 3.501561\n2.064387 3.669010 4.154747\nCe Cu Ni\n2 2 2\ndirect\n0.755217 0.688332 0.198766 Ce\n0.244783 0.311668 0.801234 Ce\n0.592711 0.236059 0.421481 Cu\n0.407289 0.763941 0.578519 Cu\n0.029170 0.127096 0.185437 Ni\n0.970830 0.872904 0.814563 Ni\n",
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"formula_full": "Ce2 Cu2 Ni2",
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"updated_at": "2021-11-28T01:37:25.699000Z",
"spacegroup": 12
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{
"id": "mp-10058",
"created_at": "2022-09-04T14:46:12.927271Z",
"structure_string": "Yb1 Co3 B2\n1.0\n2.582821 -4.473577 0.000000\n2.582821 4.473577 0.000000\n0.000000 0.000000 2.756735\nYb Co B\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.666667 0.333333 0.000000 B\n0.333333 0.666667 0.000000 B\n",
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"formula_full": "Yb1 Co3 B2",
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"formula_anonymous": "AB2C3",
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"spacegroup": 191
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{
"id": "mp-1181743",
"created_at": "2022-09-04T14:46:22.670408Z",
"structure_string": "Co1 Hg1 S4\n1.0\n-3.592617 3.592617 2.554680\n3.592617 -3.592617 2.554680\n3.592617 3.592617 -2.554680\nCo Hg S\n1 1 4\ndirect\n0.750000 0.250000 0.500000 Co\n0.000000 0.000000 0.000000 Hg\n0.354909 0.201545 0.485509 S\n0.716036 0.869400 0.514491 S\n0.130600 0.645091 0.846637 S\n0.798455 0.283964 0.153363 S\n",
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"volume": 131.89196557875846,
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"formula_full": "Co1 Hg1 S4",
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{
"id": "mp-1219900",
"created_at": "2022-09-04T14:46:12.793093Z",
"structure_string": "Pr2 U1 P3\n1.0\n-2.049524 2.907047 6.207737\n2.049524 -2.907047 6.207737\n2.049524 2.907047 -6.207737\nPr U P\n2 1 3\ndirect\n0.668256 0.668256 0.000000 Pr\n0.331744 0.331744 0.000000 Pr\n0.000000 0.000000 0.000000 U\n0.500000 0.000000 0.500000 P\n0.154005 0.654005 0.500000 P\n0.845995 0.345995 0.500000 P\n",
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{
"id": "mp-1210773",
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"structure_string": "Mn2 Ga2 Ni2\n1.0\n-2.064371 -3.575594 0.000000\n-2.064371 3.575594 0.000000\n0.000000 0.000000 -5.166194\nMn Ga Ni\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.666667 0.333333 0.750000 Ga\n0.333333 0.666667 0.250000 Ga\n0.666667 0.333333 0.250000 Ni\n0.333333 0.666667 0.750000 Ni\n",
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{
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{
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"created_at": "2022-09-04T14:46:11.032094Z",
"structure_string": "Ca1 Mg1 Ni4\n1.0\n0.000000 3.498004 3.498004\n3.498004 0.000000 3.498004\n3.498004 3.498004 0.000000\nCa Mg Ni\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ca\n0.250000 0.250000 0.250000 Mg\n0.624298 0.624298 0.624298 Ni\n0.127105 0.624298 0.624298 Ni\n0.624298 0.127105 0.624298 Ni\n0.624298 0.624298 0.127105 Ni\n",
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"volume": 85.6033776484318,
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"formula_full": "Ca1 Mg1 Ni4",
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"energy": -27.91949194,
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]
}