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{
"id": "mp-867291",
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{
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{
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"structure_string": "Ca1 Co1 O3\n1.0\n3.763490 0.000000 0.000000\n0.000000 3.763490 0.000000\n0.000000 0.000000 3.763490\nCa Co O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Co\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n",
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},
{
"id": "mp-1181903",
"created_at": "2022-09-04T14:39:21.574392Z",
"structure_string": "Ca4 O4\n1.0\n3.974914 3.974914 0.000000\n0.000000 3.974914 3.974914\n3.974914 0.000000 3.974914\nCa O\n4 4\ndirect\n0.000000 0.500000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.500000 0.000000 0.000000 Ca\n0.000000 0.000000 0.000000 Ca\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.500000 O\n",
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"formula_full": "Ca4 O4",
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{
"id": "mp-1027865",
"created_at": "2022-09-04T14:43:20.510775Z",
"structure_string": "Sr1 Mg14 Fe1\n1.0\n6.381416 -0.000000 -0.000000\n-3.190708 5.526467 0.000000\n-0.000000 0.000000 10.316283\nSr Mg Fe\n1 14 1\ndirect\n0.166667 0.333333 0.625000 Sr\n0.154734 0.827366 0.125000 Mg\n0.179733 0.839866 0.625000 Mg\n0.672634 0.345266 0.125000 Mg\n0.660134 0.320267 0.625000 Mg\n0.672634 0.827366 0.125000 Mg\n0.660134 0.839866 0.625000 Mg\n0.328586 0.171414 0.345520 Mg\n0.328586 0.171414 0.904480 Mg\n0.328586 0.657174 0.345520 Mg\n0.328586 0.657174 0.904480 Mg\n0.842826 0.171414 0.345520 Mg\n0.842826 0.171414 0.904480 Mg\n0.833333 0.666667 0.387213 Mg\n0.833333 0.666667 0.862787 Mg\n0.166667 0.333333 0.125000 Fe\n",
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"elements": [
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},
{
"id": "mp-1069520",
"created_at": "2022-09-04T14:47:22.870397Z",
"structure_string": "Zr2 Cu1 H2\n1.0\n-1.629054 1.629054 5.895469\n1.629054 -1.629054 5.895469\n1.629054 1.629054 -5.895469\nZr Cu H\n2 1 2\ndirect\n0.638599 0.638599 0.000000 Zr\n0.361401 0.361401 0.000000 Zr\n0.000000 0.000000 0.000000 Cu\n0.750000 0.250000 0.500000 H\n0.250000 0.750000 0.500000 H\n",
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"formula_full": "Zr2 Cu1 H2",
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"formula_anonymous": "AB2C2",
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"updated_at": "2021-11-28T01:38:06.348000Z",
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{
"id": "mp-1021360",
"created_at": "2022-09-04T14:40:44.216392Z",
"structure_string": "K2 Mg12 Si2\n1.0\n4.637424 0.000000 0.000000\n0.000000 6.298524 0.000000\n0.000000 0.000000 14.183072\nK Mg Si\n2 12 2\ndirect\n0.000000 0.500000 0.287712 K\n0.000000 0.000000 0.787712 K\n0.000000 0.246986 0.077256 Mg\n0.000000 0.753014 0.077256 Mg\n0.000000 0.000000 0.360403 Mg\n0.500000 0.747720 0.446060 Mg\n0.500000 0.252280 0.446060 Mg\n0.500000 0.000000 0.192744 Mg\n0.000000 0.746986 0.577256 Mg\n0.000000 0.253014 0.577256 Mg\n0.000000 0.500000 0.860403 Mg\n0.500000 0.247720 0.946060 Mg\n0.500000 0.752280 0.946060 Mg\n0.500000 0.500000 0.692744 Mg\n0.500000 0.500000 0.112509 Si\n0.500000 0.000000 0.612509 Si\n",
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{
"id": "mp-1111999",
"created_at": "2022-09-04T14:40:01.499594Z",
"structure_string": "K2 Al1 Au1 Br6\n1.0\n0.000000 5.382125 5.382125\n5.382125 0.000000 5.382125\n5.382125 5.382125 0.000000\nK Al Au 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 Al\n0.500000 0.500000 0.500000 Au\n0.763582 0.236418 0.236418 Br\n0.236418 0.236418 0.763582 Br\n0.236418 0.763582 0.763582 Br\n0.236418 0.763582 0.236418 Br\n0.763582 0.236418 0.763582 Br\n0.763582 0.763582 0.236418 Br\n",
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{
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"structure_string": "Li1 Mg14 Si1\n1.0\n6.234642 -0.027991 0.000000\n-3.141562 5.441344 0.000000\n0.000000 0.000000 10.306612\nLi Mg Si\n1 14 1\ndirect\n0.166097 0.333048 0.125000 Li\n0.169253 0.334626 0.625000 Mg\n0.167377 0.833688 0.625000 Mg\n0.670735 0.332854 0.125000 Mg\n0.665829 0.334610 0.625000 Mg\n0.670735 0.837880 0.125000 Mg\n0.665829 0.831218 0.625000 Mg\n0.328367 0.161866 0.366813 Mg\n0.328367 0.161866 0.883187 Mg\n0.328367 0.666502 0.366813 Mg\n0.328367 0.666502 0.883187 Mg\n0.833858 0.166930 0.376933 Mg\n0.833858 0.166930 0.873067 Mg\n0.837257 0.668629 0.368884 Mg\n0.837257 0.668629 0.881116 Mg\n0.168444 0.834222 0.125000 Si\n",
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{
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{
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"structure_string": "Rb2 In1 Sb1 Br6\n1.0\n0.000000 5.883962 5.883962\n5.883962 0.000000 5.883962\n5.883962 5.883962 0.000000\nRb In Sb Br\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 In\n0.000000 0.000000 0.000000 Sb\n0.759591 0.240409 0.240409 Br\n0.240409 0.240409 0.759591 Br\n0.240409 0.759591 0.759591 Br\n0.240409 0.759591 0.240409 Br\n0.759591 0.240409 0.759591 Br\n0.759591 0.759591 0.240409 Br\n",
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"volume": 407.417400567011,
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{
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"structure_string": "La1 Nd1 Ir2\n1.0\n0.000000 3.578985 3.578985\n3.578985 0.000000 3.578985\n3.578985 3.578985 0.000000\nLa Nd Ir\n1 1 2\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Nd\n0.250000 0.250000 0.250000 Ir\n0.750000 0.750000 0.750000 Ir\n",
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]
}