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{
"id": "mp-1113385",
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"structure_string": "Rb2 Hg1 Sb1 Cl6\n1.0\n0.000000 5.538768 5.538768\n5.538768 0.000000 5.538768\n5.538768 5.538768 0.000000\nRb Hg Sb Cl\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 Hg\n0.000000 0.000000 0.000000 Sb\n0.761332 0.238668 0.238668 Cl\n0.238668 0.238668 0.761332 Cl\n0.238668 0.761332 0.761332 Cl\n0.238668 0.761332 0.238668 Cl\n0.761332 0.238668 0.761332 Cl\n0.761332 0.761332 0.238668 Cl\n",
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{
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"created_at": "2022-09-04T14:47:01.333087Z",
"structure_string": "Rb2 Ga1 Hg1 Br6\n1.0\n0.000000 5.546088 5.546088\n5.546088 0.000000 5.546088\n5.546088 5.546088 0.000000\nRb Ga Hg Br\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 Ga\n0.500000 0.500000 0.500000 Hg\n0.763105 0.236895 0.236895 Br\n0.236895 0.236895 0.763105 Br\n0.236895 0.763105 0.763105 Br\n0.236895 0.763105 0.236895 Br\n0.763105 0.236895 0.763105 Br\n0.763105 0.763105 0.236895 Br\n",
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{
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"created_at": "2022-09-04T14:41:27.930116Z",
"structure_string": "Cs2 Tl1 Au1 I6\n1.0\n0.000000 6.069983 6.069983\n6.069983 0.000000 6.069983\n6.069983 6.069983 0.000000\nCs Tl Au I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Au\n0.739450 0.260550 0.260550 I\n0.260550 0.260550 0.739450 I\n0.260550 0.739450 0.739450 I\n0.260550 0.739450 0.260550 I\n0.739450 0.260550 0.739450 I\n0.739450 0.739450 0.260550 I\n",
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"formula_full": "Cs2 Tl1 Au1 I6",
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"spacegroup": 225
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{
"id": "mp-1113375",
"created_at": "2022-09-04T14:39:12.897634Z",
"structure_string": "Na2 Pr1 Cu1 Cl6\n1.0\n0.000000 5.236163 5.236163\n5.236163 0.000000 5.236163\n5.236163 5.236163 0.000000\nNa Pr Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Cu\n0.739384 0.260616 0.260616 Cl\n0.260616 0.260616 0.739384 Cl\n0.260616 0.739384 0.739384 Cl\n0.260616 0.739384 0.260616 Cl\n0.739384 0.260616 0.739384 Cl\n0.739384 0.739384 0.260616 Cl\n",
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"updated_at": "2021-11-28T01:34:34.681000Z",
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},
{
"id": "mp-1113374",
"created_at": "2022-09-04T14:44:22.402952Z",
"structure_string": "Na2 Nd1 Cu1 Cl6\n1.0\n0.000000 5.212924 5.212924\n5.212924 0.000000 5.212924\n5.212924 5.212924 0.000000\nNa Nd Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Cu\n0.740295 0.259705 0.259705 Cl\n0.259705 0.259705 0.740295 Cl\n0.259705 0.740295 0.740295 Cl\n0.259705 0.740295 0.259705 Cl\n0.740295 0.259705 0.740295 Cl\n0.740295 0.740295 0.259705 Cl\n",
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"updated_at": "2021-11-28T01:36:39.445000Z",
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{
"id": "mp-1113363",
"created_at": "2022-09-04T14:46:14.829010Z",
"structure_string": "Cs2 Ce1 Cu1 Cl6\n1.0\n0.000000 5.354599 5.354599\n5.354599 0.000000 5.354599\n5.354599 5.354599 0.000000\nCs Ce Cu Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Cs\n0.750000 0.750000 0.750000 Cs\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Cu\n0.242419 0.242419 0.757581 Cl\n0.242419 0.757581 0.757581 Cl\n0.757581 0.757581 0.242419 Cl\n0.242419 0.757581 0.242419 Cl\n0.757581 0.242419 0.757581 Cl\n0.757581 0.242419 0.242419 Cl\n",
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"density": 3.689301670108859,
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"formula_full": "Cs2 Ce1 Cu1 Cl6",
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{
"id": "mp-1113362",
"created_at": "2022-09-04T14:42:39.219825Z",
"structure_string": "Cs2 Ce1 Cu1 I6\n1.0\n0.000000 6.035230 6.035230\n6.035230 0.000000 6.035230\n6.035230 6.035230 0.000000\nCs Ce Cu I\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Cs\n0.750000 0.750000 0.750000 Cs\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Cu\n0.240155 0.240155 0.759845 I\n0.240155 0.759845 0.759845 I\n0.759845 0.759845 0.240155 I\n0.240155 0.759845 0.240155 I\n0.759845 0.240155 0.759845 I\n0.759845 0.240155 0.240155 I\n",
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{
"id": "mp-1113355",
"created_at": "2022-09-04T14:45:59.355088Z",
"structure_string": "Cs2 Pr1 Cu1 Br6\n1.0\n0.000000 5.640971 5.640971\n5.640971 0.000000 5.640971\n5.640971 5.640971 0.000000\nCs Pr Cu Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.000000 Cu\n0.758727 0.241273 0.241273 Br\n0.241273 0.241273 0.758727 Br\n0.241273 0.758727 0.758727 Br\n0.241273 0.758727 0.241273 Br\n0.758727 0.241273 0.758727 Br\n0.758727 0.758727 0.241273 Br\n",
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{
"id": "mp-1113345",
"created_at": "2022-09-04T14:43:00.786624Z",
"structure_string": "Rb2 Al1 Hg1 Cl6\n1.0\n0.000000 5.266818 5.266818\n5.266818 0.000000 5.266818\n5.266818 5.266818 0.000000\nRb Al Hg Cl\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 Hg\n0.775899 0.224101 0.224101 Cl\n0.224101 0.224101 0.775899 Cl\n0.224101 0.775899 0.775899 Cl\n0.224101 0.775899 0.224101 Cl\n0.775899 0.224101 0.775899 Cl\n0.775899 0.775899 0.224101 Cl\n",
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{
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"structure_string": "Rb2 Ta1 Cu1 Br6\n1.0\n0.000000 5.344518 5.344518\n5.344518 0.000000 5.344518\n5.344518 5.344518 0.000000\nRb Ta Cu Br\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 Ta\n0.500000 0.500000 0.500000 Cu\n0.247642 0.752358 0.752358 Br\n0.752358 0.752358 0.247642 Br\n0.752358 0.247642 0.247642 Br\n0.752358 0.247642 0.752358 Br\n0.247642 0.752358 0.247642 Br\n0.247642 0.247642 0.752358 Br\n",
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{
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"structure_string": "Rb2 La1 Cu1 Cl6\n1.0\n0.000000 5.321814 5.321814\n5.321814 0.000000 5.321814\n5.321814 5.321814 0.000000\nRb La Cu Cl\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 La\n0.500000 0.500000 0.500000 Cu\n0.739817 0.260183 0.260183 Cl\n0.260183 0.260183 0.739817 Cl\n0.260183 0.739817 0.739817 Cl\n0.260183 0.739817 0.260183 Cl\n0.739817 0.260183 0.739817 Cl\n0.739817 0.739817 0.260183 Cl\n",
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{
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]
}