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{
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{
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"structure_string": "Sr2 Mg1 Te1 O6\n1.0\n2.835899 4.909654 0.000000\n-2.835899 4.909654 0.000000\n0.000000 3.307177 4.638203\nSr Mg Te O\n2 1 1 6\ndirect\n0.249826 0.249826 0.748032 Sr\n0.750174 0.750174 0.251968 Sr\n0.000000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Te\n0.741422 0.741422 0.800943 O\n0.258578 0.258578 0.199057 O\n0.720042 0.236500 0.262064 O\n0.763500 0.279958 0.737936 O\n0.279958 0.763500 0.737936 O\n0.236500 0.720042 0.262064 O\n",
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"formula_full": "Sr2 Mg1 Te1 O6",
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{
"id": "mp-1206445",
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"formula_full": "Re2 W6",
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{
"id": "mp-1520595",
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"structure_string": "Sr2 Cu1 W1 O6\n1.0\n-0.000000 -4.011910 -4.011910\n4.011910 -0.000000 -4.011910\n4.011910 -4.011910 0.000000\nSr Cu W O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n-0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 W\n0.742548 0.257452 0.257452 O\n0.257452 0.742548 0.742548 O\n0.742548 0.257452 0.742548 O\n0.257452 0.742548 0.257452 O\n0.742548 0.742548 0.257452 O\n0.257452 0.257452 0.742548 O\n",
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"volume_molar": 7.777400139884875,
"formula_full": "Sr2 Cu1 W1 O6",
"formula_reduced": "Sr2CuWO6",
"formula_anonymous": "ABC2D6",
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"updated_at": "2021-11-28T01:34:32.110000Z",
"spacegroup": 225
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{
"id": "mp-733",
"created_at": "2022-09-04T14:45:22.874735Z",
"structure_string": "Ge3 O6\n1.0\n2.544180 -4.406649 0.000000\n2.544180 4.406649 0.000000\n0.000000 0.000000 5.759567\nGe O\n3 6\ndirect\n0.544617 0.544617 0.000000 Ge\n0.000000 0.455383 0.666667 Ge\n0.455383 0.000000 0.333333 Ge\n0.298183 0.398075 0.758473 O\n0.601925 0.900108 0.091806 O\n0.099892 0.701817 0.425139 O\n0.398075 0.298183 0.241527 O\n0.701817 0.099892 0.574861 O\n0.900108 0.601925 0.908194 O\n",
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],
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"volume": 129.14456207953944,
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"formula_full": "Ge3 O6",
"formula_reduced": "GeO2",
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"updated_at": "2021-11-28T01:37:08.909000Z",
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},
{
"id": "mp-1205988",
"created_at": "2022-09-04T14:46:23.560918Z",
"structure_string": "La2 Ni1 W1 O6\n1.0\n0.000000 4.011857 4.011857\n4.011857 0.000000 4.011857\n4.011857 4.011857 0.000000\nLa Ni W O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 La\n0.750000 0.750000 0.750000 La\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 W\n0.748727 0.251273 0.251273 O\n0.251273 0.748727 0.748727 O\n0.251273 0.748727 0.251273 O\n0.748727 0.251273 0.748727 O\n0.251273 0.251273 0.748727 O\n0.748727 0.748727 0.251273 O\n",
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"formula_full": "La2 Ni1 W1 O6",
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{
"id": "mp-1221950",
"created_at": "2022-09-04T14:39:26.564612Z",
"structure_string": "Mg2 Mn4 O6\n1.0\n-2.208475 -2.208473 0.000000\n-2.192839 2.192837 -4.396845\n4.433007 -4.433004 -4.444199\nMg Mn O\n2 4 6\ndirect\n0.000000 0.000002 0.000001 Mg\n0.500000 0.499997 0.999998 Mg\n0.000000 0.666269 0.328704 Mn\n0.500000 0.833735 0.671297 Mn\n0.500000 0.166283 0.328722 Mn\n0.999999 0.333719 0.671279 Mn\n0.000000 0.999996 0.500000 O\n0.500000 0.500003 0.499999 O\n0.500001 0.166748 0.845346 O\n0.000001 0.666751 0.845344 O\n0.000000 0.333252 0.154654 O\n0.500000 0.833248 0.154656 O\n",
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"density": 4.685201298342143,
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"volume": 129.13674734850593,
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"formula_full": "Mg2 Mn4 O6",
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"spacegroup": 164
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{
"id": "mp-1516717",
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"structure_string": "Eu1 Mg1 Sn1 W1 O6\n1.0\n-0.000000 -4.011791 -4.011791\n4.011791 -0.000000 -4.011791\n4.011791 -4.011791 0.000000\nEu Mg Sn W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Eu\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Sn\n0.500000 0.500000 0.500000 W\n0.743186 0.256814 0.256814 O\n0.256814 0.743186 0.743186 O\n0.743186 0.256814 0.743186 O\n0.256814 0.743186 0.256814 O\n0.743186 0.743186 0.256814 O\n0.256814 0.256814 0.743186 O\n",
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"formula_full": "Eu1 Mg1 Sn1 W1 O6",
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{
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"structure_string": "Ba1 Ca1 Mn1 Sn1 O6\n1.0\n0.000000 -4.011772 -4.011772\n4.011772 0.000000 -4.011772\n4.011772 -4.011772 0.000000\nBa Ca Mn Sn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ca\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Sn\n0.757553 0.242447 0.242447 O\n0.242447 0.757553 0.757553 O\n0.757553 0.242447 0.757553 O\n0.242447 0.757553 0.242447 O\n0.757553 0.757553 0.242447 O\n0.242447 0.242447 0.757553 O\n",
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"formula_full": "Ba1 Ca1 Mn1 Sn1 O6",
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{
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{
"id": "mp-761324",
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"structure_string": "Li2 Si2 Ni2 O8\n1.0\n-4.186419 3.928438 0.101021\n4.186332 0.100918 3.928440\n4.186328 3.928344 0.100935\nLi Si Ni O\n2 2 2 8\ndirect\n0.998009 0.999999 0.001990 Li\n0.251992 0.500001 0.248009 Li\n0.625000 0.249999 0.125000 Si\n0.625000 0.750000 0.625000 Si\n0.625000 0.250000 0.624999 Ni\n0.124997 0.749999 0.625003 Ni\n0.837041 0.210851 0.373817 O\n0.406943 0.232887 0.360179 O\n0.843067 0.732888 0.424055 O\n0.843057 0.267113 0.889820 O\n0.412960 0.289149 0.876183 O\n0.834661 0.710850 0.876196 O\n0.415340 0.789151 0.373804 O\n0.406933 0.767112 0.825944 O\n",
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]
}