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{
"id": "mp-1113822",
"created_at": "2022-09-04T14:45:27.731425Z",
"structure_string": "Rb3 Sc1 F6\n1.0\n0.000000 4.703181 4.703181\n4.703181 0.000000 4.703181\n4.703181 4.703181 0.000000\nRb Sc F\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Sc\n0.783537 0.216463 0.216463 F\n0.216463 0.216463 0.783537 F\n0.216463 0.783537 0.783537 F\n0.216463 0.783537 0.216463 F\n0.783537 0.216463 0.783537 F\n0.783537 0.783537 0.216463 F\n",
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{
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},
{
"id": "mp-1113820",
"created_at": "2022-09-04T14:42:42.445501Z",
"structure_string": "Rb3 Ti1 F6\n1.0\n0.000000 4.658364 4.658364\n4.658364 0.000000 4.658364\n4.658364 4.658364 0.000000\nRb Ti F\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Ti\n0.786083 0.213917 0.213917 F\n0.213917 0.213917 0.786083 F\n0.213917 0.786083 0.786083 F\n0.213917 0.786083 0.213917 F\n0.786083 0.213917 0.786083 F\n0.786083 0.786083 0.213917 F\n",
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"elements": [
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"density": 3.435310706508746,
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"volume": 202.17630649647063,
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"formula_full": "Rb3 Ti1 F6",
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"updated_at": "2021-11-28T01:35:53.093000Z",
"spacegroup": 225
},
{
"id": "mp-1113818",
"created_at": "2022-09-04T14:40:09.009757Z",
"structure_string": "Rb2 Al1 Cu1 F6\n1.0\n0.000000 4.187194 4.187194\n4.187194 0.000000 4.187194\n4.187194 4.187194 0.000000\nRb Al Cu 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 Al\n0.500000 0.500000 0.500000 Cu\n0.779060 0.220940 0.220940 F\n0.220940 0.220940 0.779060 F\n0.220940 0.779060 0.779060 F\n0.220940 0.779060 0.220940 F\n0.779060 0.220940 0.779060 F\n0.779060 0.779060 0.220940 F\n",
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"elements": [
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],
"chemical_system": "Al-Cu-F-Rb",
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"volume": 146.82474139942218,
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"formula_full": "Rb2 Al1 Cu1 F6",
"formula_reduced": "Rb2AlCuF6",
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},
{
"id": "mp-1113817",
"created_at": "2022-09-04T14:41:50.446345Z",
"structure_string": "Rb2 Cu1 Bi1 F6\n1.0\n6.396958 -0.000000 -0.000000\n3.198479 5.539928 -0.000000\n3.198479 1.846643 5.223094\nRb Cu Bi 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 Cu\n0.000000 0.000000 0.000000 Bi\n0.253399 0.746601 0.253399 F\n0.746601 0.746601 0.253399 F\n0.746601 0.253399 0.746601 F\n0.746601 0.253399 0.253399 F\n0.253399 0.746601 0.746601 F\n0.253399 0.253399 0.746601 F\n",
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"elements": [
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],
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"density": 5.000937654578033,
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"volume": 185.09959207447582,
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"formula_full": "Rb2 Cu1 Bi1 F6",
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"updated_at": "2021-11-28T01:35:29.216000Z",
"spacegroup": 225
},
{
"id": "mp-1113808",
"created_at": "2022-09-04T14:44:12.482129Z",
"structure_string": "Rb2 Mn1 Cu1 F6\n1.0\n5.951939 0.000000 0.000000\n2.975970 5.154531 0.000000\n2.975970 1.718177 4.859738\nRb Mn Cu F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Cu\n0.243517 0.756483 0.243517 F\n0.756483 0.756483 0.243517 F\n0.756483 0.243517 0.756483 F\n0.756483 0.243517 0.243517 F\n0.243517 0.756483 0.756483 F\n0.243517 0.243517 0.756483 F\n",
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],
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"density": 4.492988869108731,
"density_atomic": 0.06707173125661563,
"volume": 149.09410883908933,
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"formula_full": "Rb2 Mn1 Cu1 F6",
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"formula_anonymous": "ABC2D6",
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"updated_at": "2021-11-28T01:36:30.662000Z",
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},
{
"id": "mp-1113807",
"created_at": "2022-09-04T14:46:52.705234Z",
"structure_string": "Rb2 In1 Cu1 F6\n1.0\n0.000000 4.378657 4.378657\n4.378657 0.000000 4.378657\n4.378657 4.378657 0.000000\nRb In Cu 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 Cu\n0.755875 0.244125 0.244125 F\n0.244125 0.244125 0.755875 F\n0.244125 0.755875 0.755875 F\n0.244125 0.755875 0.244125 F\n0.755875 0.244125 0.755875 F\n0.755875 0.755875 0.244125 F\n",
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"elements": [
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],
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"density": 4.581938620967626,
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"volume": 167.90080349985107,
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"formula_full": "Rb2 In1 Cu1 F6",
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{
"id": "mp-1113802",
"created_at": "2022-09-04T14:41:23.279023Z",
"structure_string": "Rb2 Pr1 Cu1 F6\n1.0\n6.476834 -0.000000 -0.000000\n3.238417 5.609103 -0.000000\n3.238417 1.869701 5.288313\nRb Pr Cu 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 Pr\n0.000000 0.000000 0.000000 Cu\n0.249071 0.750929 0.249071 F\n0.750929 0.750929 0.249071 F\n0.750929 0.249071 0.750929 F\n0.750929 0.249071 0.249071 F\n0.249071 0.750929 0.750929 F\n0.249071 0.249071 0.750929 F\n",
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],
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"density": 4.2298180611030025,
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"formula_full": "Rb2 Pr1 Cu1 F6",
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{
"id": "mp-1113796",
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"structure_string": "Rb2 Sc1 Cu1 F6\n1.0\n6.127498 -0.000000 -0.000000\n3.063749 5.306569 -0.000000\n3.063749 1.768856 5.003081\nRb Sc Cu F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Cu\n0.235863 0.764137 0.235863 F\n0.764137 0.764137 0.235863 F\n0.764137 0.235863 0.764137 F\n0.764137 0.235863 0.235863 F\n0.235863 0.764137 0.764137 F\n0.235863 0.235863 0.764137 F\n",
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{
"id": "mp-1113795",
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"structure_string": "Rb2 Cu1 Ru1 F6\n1.0\n0.000000 4.256436 4.256436\n4.256436 0.000000 4.256436\n4.256436 4.256436 0.000000\nRb Cu Ru F\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 Cu\n0.000000 0.000000 0.000000 Ru\n0.756800 0.243200 0.243200 F\n0.243200 0.243200 0.756800 F\n0.243200 0.756800 0.756800 F\n0.243200 0.756800 0.243200 F\n0.756800 0.243200 0.756800 F\n0.756800 0.756800 0.243200 F\n",
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"formula_full": "Rb2 Cu1 Ru1 F6",
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{
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"structure_string": "Rb2 Tl1 Cu1 F6\n1.0\n0.000000 4.415142 4.415142\n4.415142 0.000000 4.415142\n4.415142 4.415142 0.000000\nRb Tl Cu 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 Tl\n0.500000 0.500000 0.500000 Cu\n0.734407 0.265593 0.265593 F\n0.265593 0.265593 0.734407 F\n0.265593 0.734407 0.734407 F\n0.265593 0.734407 0.265593 F\n0.734407 0.265593 0.734407 F\n0.734407 0.734407 0.265593 F\n",
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{
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]
}