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{
"id": "mp-1112234",
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"structure_string": "K2 Ga1 Hg1 F6\n1.0\n0.000000 4.461576 4.461576\n4.461576 0.000000 4.461576\n4.461576 4.461576 0.000000\nK Ga Hg F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Hg\n0.783735 0.216265 0.216265 F\n0.216265 0.216265 0.783735 F\n0.216265 0.783735 0.783735 F\n0.216265 0.783735 0.216265 F\n0.783735 0.216265 0.783735 F\n0.783735 0.783735 0.216265 F\n",
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{
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"structure_string": "K2 La1 Cu1 Cl6\n1.0\n0.000000 5.302171 5.302171\n5.302171 0.000000 5.302171\n5.302171 5.302171 0.000000\nK La Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Cu\n0.739440 0.260560 0.260560 Cl\n0.260560 0.260560 0.739440 Cl\n0.260560 0.739440 0.739440 Cl\n0.260560 0.739440 0.260560 Cl\n0.739440 0.260560 0.739440 Cl\n0.739440 0.739440 0.260560 Cl\n",
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{
"id": "mp-1112229",
"created_at": "2022-09-04T14:44:08.505896Z",
"structure_string": "K2 Lu1 Cu1 Cl6\n1.0\n0.000000 5.124658 5.124658\n5.124658 0.000000 5.124658\n5.124658 5.124658 0.000000\nK Lu Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 Cu\n0.748660 0.251340 0.251340 Cl\n0.251340 0.251340 0.748660 Cl\n0.251340 0.748660 0.748660 Cl\n0.251340 0.748660 0.251340 Cl\n0.748660 0.251340 0.748660 Cl\n0.748660 0.748660 0.251340 Cl\n",
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"formula_full": "K2 Lu1 Cu1 Cl6",
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{
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"created_at": "2022-09-04T14:46:36.338785Z",
"structure_string": "K2 Nd1 Cu1 Cl6\n1.0\n0.000000 5.261519 5.261519\n5.261519 0.000000 5.261519\n5.261519 5.261519 0.000000\nK Nd Cu Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Cu\n0.258661 0.741339 0.741339 Cl\n0.741339 0.741339 0.258661 Cl\n0.741339 0.258661 0.258661 Cl\n0.741339 0.258661 0.741339 Cl\n0.258661 0.741339 0.258661 Cl\n0.258661 0.258661 0.741339 Cl\n",
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"elements": [
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"density": 2.842675622095881,
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"formula_full": "K2 Nd1 Cu1 Cl6",
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{
"id": "mp-1112226",
"created_at": "2022-09-04T14:40:06.099352Z",
"structure_string": "Rb2 Hg1 Mo1 F6\n1.0\n6.978333 0.000000 0.000000\n3.489167 6.043413 0.000000\n3.489167 2.014471 5.697785\nRb Hg Mo F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Mo\n0.201017 0.798983 0.201017 F\n0.798983 0.798983 0.201017 F\n0.798983 0.201017 0.798983 F\n0.798983 0.201017 0.201017 F\n0.201017 0.798983 0.798983 F\n0.201017 0.201017 0.798983 F\n",
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"updated_at": "2021-11-28T01:34:56.574000Z",
"spacegroup": 225
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{
"id": "mp-1112225",
"created_at": "2022-09-04T14:39:33.591752Z",
"structure_string": "Rb2 In1 Hg1 F6\n1.0\n0.000000 4.661546 4.661546\n4.661546 0.000000 4.661546\n4.661546 4.661546 0.000000\nRb In Hg F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Hg\n0.773014 0.226986 0.226986 F\n0.226986 0.226986 0.773014 F\n0.226986 0.773014 0.773014 F\n0.226986 0.773014 0.226986 F\n0.773014 0.226986 0.773014 F\n0.773014 0.773014 0.226986 F\n",
"nsites": 10,
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"formula_full": "Rb2 In1 Hg1 F6",
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{
"id": "mp-1112221",
"created_at": "2022-09-04T14:48:15.645712Z",
"structure_string": "K2 In1 Ga1 F6\n1.0\n0.000000 4.551746 4.551746\n4.551746 0.000000 4.551746\n4.551746 4.551746 0.000000\nK In Ga F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Ga\n0.268108 0.268108 0.731892 F\n0.268108 0.731892 0.731892 F\n0.731892 0.731892 0.268108 F\n0.268108 0.731892 0.268108 F\n0.731892 0.268108 0.731892 F\n0.731892 0.268108 0.268108 F\n",
"nsites": 10,
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"density": 3.316751744422506,
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"volume": 188.60971262513218,
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{
"id": "mp-1112220",
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"structure_string": "K2 Pr1 Cu1 Cl6\n1.0\n0.000000 5.284084 5.284084\n5.284084 0.000000 5.284084\n5.284084 5.284084 0.000000\nK Pr Cu Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.000000 Cu\n0.240505 0.240505 0.759495 Cl\n0.240505 0.759495 0.759495 Cl\n0.759495 0.759495 0.240505 Cl\n0.240505 0.759495 0.240505 Cl\n0.759495 0.240505 0.759495 Cl\n0.759495 0.240505 0.240505 Cl\n",
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{
"id": "mp-1112218",
"created_at": "2022-09-04T14:41:22.740374Z",
"structure_string": "K2 Sm1 Cu1 Cl6\n1.0\n0.000000 5.231115 5.231115\n5.231115 0.000000 5.231115\n5.231115 5.231115 0.000000\nK Sm Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Cu\n0.742947 0.257053 0.257053 Cl\n0.257053 0.257053 0.742947 Cl\n0.257053 0.742947 0.742947 Cl\n0.257053 0.742947 0.257053 Cl\n0.742947 0.257053 0.742947 Cl\n0.742947 0.742947 0.257053 Cl\n",
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{
"id": "mp-1112217",
"created_at": "2022-09-04T14:41:32.529227Z",
"structure_string": "K2 Ta1 Cu1 Br6\n1.0\n0.000000 5.319697 5.319697\n5.319697 0.000000 5.319697\n5.319697 5.319697 0.000000\nK Ta Cu Br\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 Ta\n0.000000 0.000000 0.000000 Cu\n0.251396 0.251396 0.748604 Br\n0.251396 0.748604 0.748604 Br\n0.748604 0.748604 0.251396 Br\n0.251396 0.748604 0.251396 Br\n0.748604 0.251396 0.748604 Br\n0.748604 0.251396 0.251396 Br\n",
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{
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"structure_string": "K2 Tl1 Cu1 Br6\n1.0\n0.000000 5.460393 5.460393\n5.460393 0.000000 5.460393\n5.460393 5.460393 0.000000\nK Tl Cu Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Cu\n0.737266 0.262734 0.262734 Br\n0.262734 0.262734 0.737266 Br\n0.262734 0.737266 0.737266 Br\n0.262734 0.737266 0.262734 Br\n0.737266 0.262734 0.737266 Br\n0.737266 0.737266 0.262734 Br\n",
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{
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"structure_string": "K2 Tm1 Cu1 Cl6\n1.0\n0.000000 5.142632 5.142632\n5.142632 0.000000 5.142632\n5.142632 5.142632 0.000000\nK Tm Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Cu\n0.747646 0.252354 0.252354 Cl\n0.252354 0.252354 0.747646 Cl\n0.252354 0.747646 0.747646 Cl\n0.252354 0.747646 0.252354 Cl\n0.747646 0.252354 0.747646 Cl\n0.747646 0.747646 0.252354 Cl\n",
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]
}