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{
"id": "mp-1184876",
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{
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{
"id": "mp-1094629",
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"structure_string": "Mg2 Ga4\n1.0\n2.625330 -4.547204 0.000000\n2.625330 4.547204 0.000000\n0.000000 0.000000 4.873449\nMg Ga\n2 4\ndirect\n0.666667 0.333333 0.500000 Mg\n0.333333 0.666667 0.500000 Mg\n0.000000 0.666646 0.000000 Ga\n0.666646 0.000000 0.000000 Ga\n0.333354 0.333354 0.000000 Ga\n0.000000 0.000000 0.500000 Ga\n",
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{
"id": "mp-27474",
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"structure_string": "Pa2 Br8\n1.0\n-4.462045 4.462045 4.097930\n4.462045 -4.462045 4.097930\n4.462045 4.462045 -4.097930\nPa Br\n2 8\ndirect\n0.000000 0.000000 0.000000 Pa\n0.250000 0.750000 0.500000 Pa\n0.382809 0.071577 0.311232 Br\n0.321577 0.510345 0.188768 Br\n0.321577 0.132809 0.811232 Br\n0.760345 0.071577 0.688768 Br\n0.928423 0.617191 0.688768 Br\n0.489655 0.678423 0.811232 Br\n0.867191 0.678423 0.188768 Br\n0.928423 0.239655 0.311232 Br\n",
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"formula_full": "Pa2 Br8",
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{
"id": "mp-1187591",
"created_at": "2022-09-04T14:39:45.931691Z",
"structure_string": "Ti6 N4\n1.0\n5.049874 -2.598899 0.000000\n5.049874 2.598899 0.000000\n3.712360 0.000000 4.298126\nTi N\n6 4\ndirect\n0.573050 0.926950 0.250000 Ti\n0.250000 0.573050 0.926950 Ti\n0.926950 0.250000 0.573050 Ti\n0.073050 0.750000 0.426950 Ti\n0.750000 0.426950 0.073050 Ti\n0.426950 0.073050 0.750000 Ti\n0.840595 0.840595 0.840595 N\n0.659405 0.659405 0.659405 N\n0.340595 0.340595 0.340595 N\n0.159405 0.159405 0.159405 N\n",
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"elements": [
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"volume": 112.81817822943584,
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"formula_full": "Ti6 N4",
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{
"id": "mp-20438",
"created_at": "2022-09-04T14:39:44.390824Z",
"structure_string": "Pu1 Te1\n1.0\n3.804364 0.000000 0.000000\n0.000000 3.804364 0.000000\n0.000000 0.000000 3.804364\nPu Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500000 Te\n",
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"formula_full": "Pu1 Te1",
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"updated_at": "2021-11-28T01:34:38.185000Z",
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{
"id": "mp-1094724",
"created_at": "2022-09-04T14:39:45.184526Z",
"structure_string": "Mg3 Sb1\n1.0\n4.522794 0.000000 0.000000\n0.000000 4.522794 0.000000\n0.000000 0.000000 4.522794\nMg Sb\n3 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
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{
"id": "mp-973308",
"created_at": "2022-09-04T14:39:45.196812Z",
"structure_string": "Mg1 In3\n1.0\n-2.305174 2.305174 4.821600\n2.305174 -2.305174 4.821600\n2.305174 2.305174 -4.821600\nMg In\n1 3\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 In\n0.750000 0.250000 0.500000 In\n0.250000 0.750000 0.500000 In\n",
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{
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"structure_string": "Zn6 Rh2\n1.0\n2.723567 -4.717357 0.000000\n2.723567 4.717357 0.000000\n0.000000 0.000000 4.404182\nZn Rh\n6 2\ndirect\n0.168083 0.336167 0.250000 Zn\n0.663833 0.831917 0.250000 Zn\n0.168083 0.831917 0.250000 Zn\n0.831917 0.663833 0.750000 Zn\n0.336167 0.168083 0.750000 Zn\n0.831917 0.168083 0.750000 Zn\n0.333333 0.666667 0.750000 Rh\n0.666667 0.333333 0.250000 Rh\n",
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{
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"structure_string": "K6 Nd2\n1.0\n4.330941 -7.501409 0.000000\n4.330941 7.501409 0.000000\n0.000000 0.000000 7.174154\nK Nd\n6 2\ndirect\n0.828990 0.171010 0.750000 K\n0.342019 0.171010 0.750000 K\n0.828990 0.657981 0.750000 K\n0.171010 0.828990 0.250000 K\n0.657981 0.828990 0.250000 K\n0.171010 0.342019 0.250000 K\n0.666667 0.333333 0.250000 Nd\n0.333333 0.666667 0.750000 Nd\n",
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{
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{
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