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{
"id": "mp-1233374",
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"structure_string": "Ba2 Mg1 V2 Si4 O14\n1.0\n-0.001424 -0.010608 5.595648\n7.348792 0.112669 -0.001790\n0.124531 7.698091 -2.810662\nBa Mg V Si O\n2 1 2 4 14\ndirect\n0.816205 0.751247 0.604451 Ba\n0.222618 0.233414 0.410166 Ba\n0.147412 0.492657 0.007774 Mg\n0.118035 0.762974 0.229256 V\n0.893477 0.221891 0.786380 V\n0.427960 0.519357 0.794328 Si\n0.644227 0.465408 0.219939 Si\n0.409135 0.963860 0.799269 Si\n0.621200 0.020413 0.215543 Si\n0.137385 0.444948 0.748298 O\n0.400881 0.539442 0.266920 O\n0.120979 0.048196 0.711205 O\n0.422991 0.936093 0.304666 O\n0.542260 0.492949 0.007159 O\n0.517868 0.991052 0.007616 O\n0.006323 0.732556 0.995245 O\n0.019033 0.252621 0.020416 O\n0.392363 0.742634 0.745956 O\n0.657808 0.241967 0.267643 O\n0.607708 0.429747 0.699850 O\n0.919200 0.555249 0.314699 O\n0.598993 0.047128 0.704699 O\n0.906935 0.938270 0.310395 O\n",
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{
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{
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"structure_string": "U4 P8 O28\n1.0\n8.877619 0.000000 0.000000\n0.000000 8.878392 0.000000\n0.000000 0.000000 8.888855\nU P O\n4 8 28\ndirect\n0.994488 0.494844 0.749968 U\n0.494488 0.005156 0.749968 U\n0.994488 0.994844 0.250032 U\n0.494488 0.505156 0.250032 U\n0.096873 0.392684 0.351306 P\n0.392965 0.403453 0.851707 P\n0.596873 0.107316 0.351306 P\n0.892965 0.096547 0.851707 P\n0.392965 0.903453 0.148293 P\n0.096873 0.892684 0.648694 P\n0.892965 0.596547 0.148293 P\n0.596873 0.607316 0.648694 P\n0.974195 0.474227 0.249938 O\n0.224999 0.435154 0.830640 O\n0.253044 0.453544 0.310308 O\n0.053450 0.428444 0.514132 O\n0.445754 0.431840 0.013218 O\n0.936230 0.253346 0.794937 O\n0.579717 0.274521 0.312661 O\n0.436230 0.246654 0.794937 O\n0.079717 0.225479 0.312661 O\n0.945754 0.068160 0.013218 O\n0.553450 0.071556 0.514132 O\n0.724999 0.064846 0.830640 O\n0.753044 0.046456 0.310308 O\n0.474195 0.025773 0.249938 O\n0.974195 0.974227 0.750062 O\n0.224999 0.935154 0.169360 O\n0.253044 0.953544 0.689692 O\n0.445754 0.931840 0.986782 O\n0.053450 0.928444 0.485868 O\n0.936230 0.753346 0.205063 O\n0.579717 0.774521 0.687339 O\n0.436230 0.746654 0.205063 O\n0.079717 0.725479 0.687339 O\n0.945754 0.568160 0.986782 O\n0.553450 0.571556 0.485868 O\n0.753044 0.546456 0.689692 O\n0.724999 0.564846 0.169360 O\n0.474195 0.525773 0.750062 O\n",
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{
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"created_at": "2022-09-04T14:40:09.333098Z",
"structure_string": "Hg8 P4 O12 F4\n1.0\n-4.426042 4.808257 6.226859\n4.426042 -4.808257 6.226859\n4.426042 4.808257 -6.226859\nHg P O F\n8 4 12 4\ndirect\n0.306471 0.880680 0.982301 Hg\n0.693529 0.675831 0.574210 Hg\n0.306471 0.324169 0.425790 Hg\n0.898379 0.380680 0.074210 Hg\n0.898379 0.824169 0.517699 Hg\n0.101621 0.175831 0.482301 Hg\n0.101621 0.619320 0.925790 Hg\n0.693529 0.119320 0.017699 Hg\n0.692904 0.241587 0.451317 P\n0.209729 0.258413 0.951317 P\n0.307096 0.758413 0.548683 P\n0.790271 0.741587 0.048683 P\n0.601340 0.092093 0.218092 O\n0.110027 0.668780 0.441246 O\n0.601340 0.383248 0.509248 O\n0.398660 0.616752 0.490752 O\n0.772466 0.831220 0.941246 O\n0.227534 0.168780 0.058754 O\n0.398660 0.907907 0.781908 O\n0.126000 0.407907 0.009248 O\n0.874000 0.592093 0.990752 O\n0.874000 0.883248 0.281908 O\n0.126000 0.116752 0.718092 O\n0.889973 0.331220 0.558754 O\n0.596688 0.629940 0.966748 F\n0.336808 0.870060 0.466748 F\n0.403312 0.370060 0.033252 F\n0.663192 0.129940 0.533252 F\n",
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"formula_full": "Hg8 P4 O12 F4",
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{
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"created_at": "2022-09-04T14:40:09.346069Z",
"structure_string": "In4 Pd8\n1.0\n4.275374 0.000000 0.000000\n0.000000 5.720731 0.000000\n0.000000 0.000000 8.386898\nIn Pd\n4 8\ndirect\n0.250000 0.822038 0.600206 In\n0.750000 0.177962 0.399794 In\n0.250000 0.322038 0.899794 In\n0.750000 0.677962 0.100206 In\n0.250000 0.932809 0.268998 Pd\n0.750000 0.067191 0.731002 Pd\n0.250000 0.432809 0.231002 Pd\n0.750000 0.567191 0.768998 Pd\n0.750000 0.659363 0.427786 Pd\n0.250000 0.340637 0.572214 Pd\n0.750000 0.159363 0.072214 Pd\n0.250000 0.840637 0.927786 Pd\n",
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{
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"structure_string": "Mg1 Zn1\n1.0\n1.531854 -2.653249 0.000000\n1.531854 2.653249 0.000000\n0.000000 0.000000 4.545164\nMg Zn\n1 1\ndirect\n0.000000 0.000000 0.500000 Mg\n0.666667 0.333333 0.000000 Zn\n",
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{
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"structure_string": "H16 N8 O12\n1.0\n7.204071 0.000000 0.000000\n0.000000 7.902172 0.000000\n0.000000 0.000000 8.002684\nH N O\n16 8 12\ndirect\n0.833011 0.536092 0.673744 H\n0.666989 0.036092 0.673744 H\n0.166989 0.463908 0.173744 H\n0.333011 0.963908 0.173744 H\n0.735419 0.381407 0.154929 H\n0.996426 0.600001 0.453726 H\n0.829821 0.725862 0.464882 H\n0.264581 0.618593 0.654929 H\n0.003574 0.399999 0.953726 H\n0.170179 0.274138 0.964882 H\n0.496426 0.899999 0.953726 H\n0.329821 0.774138 0.964882 H\n0.235419 0.118593 0.654929 H\n0.503574 0.100001 0.453726 H\n0.670179 0.225862 0.464882 H\n0.764581 0.881407 0.154929 H\n0.238130 0.145242 0.782841 N\n0.261870 0.645242 0.782841 N\n0.761870 0.854758 0.282841 N\n0.738130 0.354758 0.282841 N\n0.618953 0.441647 0.792446 N\n0.881047 0.941647 0.792446 N\n0.381047 0.558353 0.292446 N\n0.118953 0.058353 0.292446 N\n0.810390 0.463691 0.780598 O\n0.689610 0.963691 0.780598 O\n0.189610 0.536309 0.280598 O\n0.310390 0.036309 0.280598 O\n0.576804 0.364008 0.916290 O\n0.905400 0.646612 0.532403 O\n0.423196 0.635992 0.416290 O\n0.094600 0.353388 0.032403 O\n0.405400 0.853388 0.032403 O\n0.076804 0.135992 0.416290 O\n0.594600 0.146612 0.532403 O\n0.923196 0.864008 0.916290 O\n",
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{
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"created_at": "2022-09-04T14:40:09.361747Z",
"structure_string": "Rb1 Ca1 Mg14\n1.0\n6.671555 -0.001272 0.000000\n-3.336879 5.779644 0.000000\n0.000000 0.000000 10.836388\nRb Ca Mg\n1 1 14\ndirect\n0.166741 0.833370 0.125000 Rb\n0.175047 0.337523 0.125000 Ca\n0.163003 0.331501 0.625000 Mg\n0.165071 0.832535 0.625000 Mg\n0.664998 0.331130 0.125000 Mg\n0.669144 0.333674 0.625000 Mg\n0.664998 0.833868 0.125000 Mg\n0.669144 0.835469 0.625000 Mg\n0.342217 0.177679 0.394755 Mg\n0.342217 0.177679 0.855245 Mg\n0.342217 0.664538 0.394755 Mg\n0.342217 0.664538 0.855245 Mg\n0.828122 0.164061 0.377991 Mg\n0.828122 0.164061 0.872009 Mg\n0.818371 0.659186 0.387820 Mg\n0.818371 0.659186 0.862180 Mg\n",
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{
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{
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{
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}