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{
"id": "mp-685150",
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{
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{
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"structure_string": "Li4 Cu2 As2\n1.0\n2.096809 -3.631780 0.000000\n2.096809 3.631780 0.000000\n0.000000 0.000000 7.932080\nLi Cu As\n4 2 2\ndirect\n0.666667 0.333333 0.414459 Li\n0.333333 0.666667 0.914459 Li\n0.666667 0.333333 0.085541 Li\n0.333333 0.666667 0.585541 Li\n0.000000 0.000000 0.750000 Cu\n0.000000 0.000000 0.250000 Cu\n0.333333 0.666667 0.250000 As\n0.666667 0.333333 0.750000 As\n",
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"volume": 120.80794200151568,
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"formula_full": "Li4 Cu2 As2",
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},
{
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"created_at": "2022-09-04T14:39:20.619287Z",
"structure_string": "Cs1 Ru1 O3\n1.0\n4.070421 0.000000 0.000000\n0.000000 4.070421 0.000000\n0.000000 0.000000 4.070421\nCs Ru O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Cs\n0.500000 0.500000 0.500000 Ru\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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"formula_full": "Cs1 Ru1 O3",
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"spacegroup": 221
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{
"id": "mp-1110631",
"created_at": "2022-09-04T14:42:20.720150Z",
"structure_string": "Rb2 Na1 Ga1 Br6\n1.0\n0.000000 5.504145 5.504145\n5.504145 0.000000 5.504145\n5.504145 5.504145 0.000000\nRb Na Ga Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Ga\n0.766112 0.233888 0.233888 Br\n0.233888 0.233888 0.766112 Br\n0.233888 0.766112 0.766112 Br\n0.233888 0.766112 0.233888 Br\n0.766112 0.233888 0.766112 Br\n0.766112 0.766112 0.233888 Br\n",
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"volume": 333.50288461625576,
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"formula_full": "Rb2 Na1 Ga1 Br6",
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"spacegroup": 225
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{
"id": "mp-636320",
"created_at": "2022-09-04T14:48:09.131919Z",
"structure_string": "Ti1 Ga1 Fe2\n1.0\n0.000000 2.900801 2.900801\n2.900801 0.000000 2.900801\n2.900801 2.900801 0.000000\nTi Ga Fe\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 Ga\n0.750000 0.750000 0.750000 Fe\n0.250000 0.250000 0.250000 Fe\n",
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"density_atomic": 0.08193626937071724,
"volume": 48.81842962488525,
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"formula_full": "Ti1 Ga1 Fe2",
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"updated_at": "2021-11-28T01:38:31.572000Z",
"spacegroup": 225
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{
"id": "mp-1184439",
"created_at": "2022-09-04T14:40:12.204297Z",
"structure_string": "Eu1 Y3\n1.0\n-2.574381 2.574381 5.158555\n2.574381 -2.574381 5.158555\n2.574381 2.574381 -5.158555\nEu Y\n1 3\ndirect\n0.000000 0.000000 0.000000 Eu\n0.750000 0.250000 0.500000 Y\n0.250000 0.750000 0.500000 Y\n0.500000 0.500000 0.000000 Y\n",
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"volume": 136.75200409550135,
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"formula_full": "Eu1 Y3",
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{
"id": "mp-676851",
"created_at": "2022-09-04T14:45:21.706679Z",
"structure_string": "K1 N1 O3\n1.0\n3.700605 -2.802219 0.000000\n3.700605 2.802219 0.000000\n1.578674 0.000000 4.365169\nK N O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 N\n0.773602 0.000000 0.226398 O\n0.000000 0.226398 0.773602 O\n0.226398 0.773602 0.000000 O\n",
"nsites": 5,
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],
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"density": 1.854420144520805,
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"volume": 90.53278128708851,
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"formula_full": "K1 N1 O3",
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"updated_at": "2021-11-28T01:37:08.449000Z",
"spacegroup": 155
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{
"id": "mp-1147576",
"created_at": "2022-09-04T14:43:35.330626Z",
"structure_string": "Sr2 Cu1 S2 Cl2\n1.0\n-2.361212 2.361212 7.474477\n2.361212 -2.361212 7.474477\n2.361212 2.361212 -7.474477\nSr Cu S Cl\n2 1 2 2\ndirect\n0.647443 0.647443 0.000000 Sr\n0.352557 0.352557 0.000000 Sr\n0.000000 0.000000 0.000000 Cu\n0.839368 0.839368 0.000000 S\n0.160632 0.160632 0.000000 S\n0.500000 0.000000 0.500000 Cl\n0.000000 0.500000 0.500000 Cl\n",
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"volume": 166.6904674835737,
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"formula_full": "Sr2 Cu1 S2 Cl2",
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{
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{
"id": "mp-1226220",
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"structure_string": "Cr1 Ga1 Fe2\n1.0\n1.499913 -2.060503 0.000000\n1.499913 2.060503 0.000000\n0.000000 0.000000 7.998737\nCr Ga Fe\n1 1 2\ndirect\n0.000000 0.000000 0.007816 Cr\n0.500000 0.500000 0.748183 Ga\n0.000000 0.000000 0.493943 Fe\n0.500000 0.500000 0.250058 Fe\n",
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{
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"structure_string": "Ce2 Cu4\n1.0\n-2.198036 3.321349 3.767821\n2.198036 -3.321349 3.767821\n2.198036 3.321349 -3.767821\nCe Cu\n2 4\ndirect\n0.725770 0.475770 0.250000 Ce\n0.274230 0.524230 0.750000 Ce\n0.701244 0.166067 0.535176 Cu\n0.298756 0.833933 0.464824 Cu\n0.130891 0.166067 0.964824 Cu\n0.869109 0.833933 0.035176 Cu\n",
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]
}