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{
"id": "mp-1222879",
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"structure_string": "La1 Mn1 Ni4\n1.0\n2.536791 -4.393851 0.000000\n2.536791 4.393851 0.000000\n0.000000 0.000000 4.008872\nLa Mn Ni\n1 1 4\ndirect\n0.333333 0.666667 0.000000 La\n0.666667 0.333333 0.000000 Mn\n0.000000 0.000000 0.000000 Ni\n0.330654 0.165327 0.500000 Ni\n0.834673 0.165327 0.500000 Ni\n0.834673 0.669346 0.500000 Ni\n",
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{
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{
"id": "mp-1216786",
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"structure_string": "Tl1 N1 Cl4\n1.0\n5.376101 4.877582 0.000000\n-5.376101 4.877582 0.000000\n0.000000 0.000000 5.207893\nTl N Cl\n1 1 4\ndirect\n0.059149 0.940851 0.000000 Tl\n0.427321 0.572679 0.500000 N\n0.916346 0.631110 0.000000 Cl\n0.368890 0.083654 0.000000 Cl\n0.848897 0.151103 0.258289 Cl\n0.848897 0.151103 0.741711 Cl\n",
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"volume": 273.12663045249525,
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"formula_full": "Tl1 N1 Cl4",
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"formula_anonymous": "ABC4",
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{
"id": "mp-569264",
"created_at": "2022-09-04T14:41:12.758383Z",
"structure_string": "Nd1 Ir5\n1.0\n2.679934 -4.641781 0.000000\n2.679934 4.641781 0.000000\n0.000000 0.000000 4.328851\nNd Ir\n1 5\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Ir\n0.666667 0.333333 0.000000 Ir\n0.000000 0.500000 0.500000 Ir\n0.333333 0.666667 0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n",
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"volume": 107.69892746232344,
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"formula_full": "Nd1 Ir5",
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"spacegroup": 191
},
{
"id": "mp-1226564",
"created_at": "2022-09-04T14:41:10.909890Z",
"structure_string": "Ce2 Ir2 Os2\n1.0\n-2.564231 2.737399 3.967429\n2.564231 -2.737399 3.967429\n2.564231 2.737399 -3.967429\nCe Ir Os\n2 2 2\ndirect\n0.125647 0.875647 0.250000 Ce\n0.874353 0.124353 0.750000 Ce\n0.000000 0.500000 0.500000 Ir\n0.500000 0.500000 0.000000 Ir\n0.500000 0.000000 0.000000 Os\n0.500000 0.500000 0.500000 Os\n",
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"formula_full": "Ce2 Ir2 Os2",
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"formula_anonymous": "ABC",
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{
"id": "mp-976425",
"created_at": "2022-09-04T14:41:14.605835Z",
"structure_string": "Nd4 Mg2\n1.0\n1.914929 -8.780681 0.000000\n1.914929 8.780681 0.000000\n0.000000 0.000000 5.645207\nNd Mg\n4 2\ndirect\n0.087758 0.912242 0.250000 Nd\n0.772328 0.227672 0.250000 Nd\n0.912242 0.087758 0.750000 Nd\n0.227672 0.772328 0.750000 Nd\n0.431740 0.568260 0.250000 Mg\n0.568260 0.431740 0.750000 Mg\n",
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"density": 5.471921039624543,
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"volume": 189.84131910587146,
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"formula_full": "Nd4 Mg2",
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"updated_at": "2021-11-28T01:35:17.604000Z",
"spacegroup": 63
},
{
"id": "mp-1207147",
"created_at": "2022-09-04T14:41:13.127452Z",
"structure_string": "Nd2 Sc2 Si2\n1.0\n4.652605 0.000000 0.000000\n0.000000 4.652605 0.000000\n-2.326303 -2.326303 7.075182\nNd Sc Si\n2 2 2\ndirect\n0.141079 0.141079 0.282159 Nd\n0.858921 0.858921 0.717841 Nd\n0.389225 0.389225 0.778450 Sc\n0.610775 0.610775 0.221550 Sc\n0.000000 0.500000 0.000000 Si\n0.500000 0.000000 0.000000 Si\n",
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"volume": 153.15457770408494,
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"formula_full": "Nd2 Sc2 Si2",
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"formula_anonymous": "ABC",
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"updated_at": "2021-11-28T01:35:17.035000Z",
"spacegroup": 139
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{
"id": "mp-3093",
"created_at": "2022-09-04T14:41:00.589962Z",
"structure_string": "Er1 B2 Ru3\n1.0\n2.746667 -4.757366 0.000000\n2.746667 4.757366 0.000000\n0.000000 0.000000 3.034553\nEr B Ru\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Er\n0.333333 0.666667 0.000000 B\n0.666667 0.333333 0.000000 B\n0.500000 0.000000 0.500000 Ru\n0.500000 0.500000 0.500000 Ru\n0.000000 0.500000 0.500000 Ru\n",
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"density": 10.303795313932886,
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"volume": 79.30440239989252,
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"formula_full": "Er1 B2 Ru3",
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{
"id": "mp-1209860",
"created_at": "2022-09-04T14:41:10.289611Z",
"structure_string": "Nd2 Cu1 Te2 O1\n1.0\n3.585286 0.000000 0.000000\n0.000000 3.585286 0.000000\n0.000000 0.000000 15.424939\nNd Cu Te O\n2 1 2 1\ndirect\n0.500000 0.500000 0.636220 Nd\n0.500000 0.500000 0.363780 Nd\n0.500000 0.500000 0.000000 Cu\n0.500000 0.500000 0.157311 Te\n0.500000 0.500000 0.842689 Te\n0.500000 0.500000 0.500000 O\n",
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"updated_at": "2021-11-28T01:35:10.608000Z",
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{
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"created_at": "2022-09-04T14:41:10.248494Z",
"structure_string": "La2 Mn2 Ge2\n1.0\n4.375786 0.000000 0.000000\n0.000000 4.375786 0.000000\n0.000000 0.000000 7.100350\nLa Mn Ge\n2 2 2\ndirect\n0.000000 0.500000 0.323704 La\n0.500000 0.000000 0.676296 La\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.200363 Ge\n0.000000 0.500000 0.799637 Ge\n",
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{
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"created_at": "2022-09-04T14:41:10.267769Z",
"structure_string": "Ti2 Ni2 H2\n1.0\n1.669091 -4.747790 0.000000\n1.669091 4.747790 0.000000\n0.000000 0.000000 3.840500\nTi Ni H\n2 2 2\ndirect\n0.858143 0.141857 0.750000 Ti\n0.141857 0.858143 0.250000 Ti\n0.585945 0.414055 0.750000 Ni\n0.414055 0.585945 0.250000 Ni\n0.082234 0.917766 0.750000 H\n0.917766 0.082234 0.250000 H\n",
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"spacegroup": 63
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{
"id": "mp-1094348",
"created_at": "2022-09-04T14:41:13.256194Z",
"structure_string": "Mg3 Ti3\n1.0\n1.485135 5.463268 0.000000\n-1.485135 5.463268 0.000000\n0.000000 1.854427 7.215093\nMg Ti\n3 3\ndirect\n0.611815 0.611815 0.275353 Mg\n0.333904 0.333904 0.327598 Mg\n0.941953 0.941953 0.619089 Mg\n0.004470 0.004470 0.981977 Ti\n0.663206 0.663206 0.695755 Ti\n0.277985 0.277985 0.933561 Ti\n",
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"formula_full": "Mg3 Ti3",
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"updated_at": "2021-11-28T01:35:24.320000Z",
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]
}