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{
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{
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{
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"structure_string": "Nd4 Zn2 Pt2 O12\n1.0\n5.846908 0.000000 0.000000\n0.000000 5.506260 0.000000\n0.000000 5.468466 7.893579\nNd Zn Pt O\n4 2 2 12\ndirect\n0.431075 0.232272 0.749001 Nd\n0.568925 0.767728 0.250999 Nd\n0.931075 0.767728 0.750999 Nd\n0.068925 0.232272 0.249001 Nd\n0.000000 0.500000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.035059 0.355249 0.752401 O\n0.964941 0.644751 0.247599 O\n0.535059 0.644751 0.747599 O\n0.464941 0.355249 0.252401 O\n0.704621 0.867027 0.944209 O\n0.295379 0.132973 0.055791 O\n0.204621 0.132973 0.555791 O\n0.795379 0.867027 0.444209 O\n0.195069 0.751673 0.946809 O\n0.804931 0.248327 0.053191 O\n0.695069 0.248327 0.553191 O\n0.304931 0.751673 0.446809 O\n",
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{
"id": "mp-865162",
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"structure_string": "Mg1 Ge1 Rh2\n1.0\n0.000000 3.062685 3.062685\n3.062685 0.000000 3.062685\n3.062685 3.062685 0.000000\nMg Ge Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Ge\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n",
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{
"id": "mp-1027840",
"created_at": "2022-09-04T14:44:54.917052Z",
"structure_string": "Mg14 Zr1 Cd1\n1.0\n6.429194 0.026903 0.000000\n-3.191298 5.527490 0.000000\n0.000000 0.000000 10.172655\nMg Zr Cd\n14 1 1\ndirect\n0.166636 0.333318 0.625000 Mg\n0.166356 0.833178 0.625000 Mg\n0.663299 0.327715 0.125000 Mg\n0.666638 0.333652 0.625000 Mg\n0.663299 0.835583 0.125000 Mg\n0.666638 0.832984 0.625000 Mg\n0.331675 0.168869 0.373486 Mg\n0.331675 0.168869 0.876514 Mg\n0.331675 0.662807 0.373486 Mg\n0.331675 0.662807 0.876514 Mg\n0.837952 0.168976 0.375147 Mg\n0.837952 0.168976 0.874853 Mg\n0.834264 0.667132 0.371902 Mg\n0.834264 0.667132 0.878098 Mg\n0.163416 0.331707 0.125000 Zr\n0.172586 0.836292 0.125000 Cd\n",
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"formula_full": "Mg14 Zr1 Cd1",
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"spacegroup": 38
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{
"id": "mp-1216295",
"created_at": "2022-09-04T14:44:55.063841Z",
"structure_string": "V1 Re11 B4\n1.0\n1.466594 -4.672650 0.000000\n1.466594 4.672650 0.000000\n0.000000 0.000000 14.633306\nV Re B\n1 11 4\ndirect\n0.571174 0.428826 0.000000 V\n0.864897 0.135103 0.092150 Re\n0.866626 0.133374 0.592744 Re\n0.137151 0.862849 0.151726 Re\n0.134178 0.865822 0.658713 Re\n0.864897 0.135103 0.907850 Re\n0.866626 0.133374 0.407256 Re\n0.134178 0.865822 0.341287 Re\n0.137151 0.862849 0.848274 Re\n0.576817 0.423183 0.500000 Re\n0.426119 0.573881 0.248436 Re\n0.426119 0.573881 0.751564 Re\n0.250006 0.749994 0.000000 B\n0.254788 0.745212 0.500000 B\n0.744636 0.255364 0.249120 B\n0.744636 0.255364 0.750880 B\n",
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"formula_full": "V1 Re11 B4",
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{
"id": "mp-1207527",
"created_at": "2022-09-04T14:44:55.081847Z",
"structure_string": "Yb4 Si12 Pd20\n1.0\n0.000000 -4.010561 0.000000\n-19.780651 0.000000 0.000000\n0.000000 0.000000 -7.286370\nYb Si Pd\n4 12 20\ndirect\n0.750000 0.642512 0.120141 Yb\n0.250000 0.357488 0.879859 Yb\n0.250000 0.857488 0.620141 Yb\n0.750000 0.142512 0.379859 Yb\n0.750000 0.739651 0.623375 Si\n0.250000 0.260349 0.376625 Si\n0.250000 0.760349 0.123375 Si\n0.750000 0.239651 0.876625 Si\n0.750000 0.924334 0.347573 Si\n0.250000 0.075666 0.652427 Si\n0.250000 0.575666 0.847573 Si\n0.750000 0.424334 0.152427 Si\n0.750000 0.915438 0.908063 Si\n0.250000 0.084562 0.091937 Si\n0.250000 0.584562 0.408063 Si\n0.750000 0.415438 0.591937 Si\n0.750000 0.800147 0.323741 Pd\n0.250000 0.199853 0.676259 Pd\n0.250000 0.699853 0.823741 Pd\n0.750000 0.300147 0.176259 Pd\n0.750000 0.991807 0.626299 Pd\n0.250000 0.008193 0.373701 Pd\n0.250000 0.508193 0.126299 Pd\n0.750000 0.491807 0.873701 Pd\n0.750000 0.514233 0.378581 Pd\n0.250000 0.485767 0.621419 Pd\n0.250000 0.985767 0.878581 Pd\n0.750000 0.014233 0.121419 Pd\n0.750000 0.795944 0.926733 Pd\n0.250000 0.204056 0.073267 Pd\n0.250000 0.704056 0.426733 Pd\n0.750000 0.295944 0.573267 Pd\n0.750000 0.616668 0.650549 Pd\n0.250000 0.383331 0.349451 Pd\n0.250000 0.883332 0.150549 Pd\n0.750000 0.116668 0.849451 Pd\n",
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{
"id": "mp-1192746",
"created_at": "2022-09-04T14:44:54.487087Z",
"structure_string": "Li2 As4 H6 O14\n1.0\n4.725481 5.801836 0.000000\n-4.725481 5.801836 0.000000\n0.000000 2.456077 5.141021\nLi As H O\n2 4 6 14\ndirect\n0.152071 0.847929 0.000000 Li\n0.847929 0.152071 0.000000 Li\n0.269235 0.269235 0.950570 As\n0.730765 0.730765 0.049430 As\n0.349625 0.650375 0.500000 As\n0.650375 0.349625 0.500000 As\n0.027619 0.718153 0.502754 H\n0.718153 0.027619 0.502754 H\n0.972381 0.281847 0.497246 H\n0.281847 0.972381 0.497246 H\n0.308038 0.308038 0.323077 H\n0.691962 0.691962 0.676923 H\n0.132669 0.132669 0.922318 O\n0.867331 0.867331 0.077682 O\n0.207869 0.514681 0.837320 O\n0.514681 0.207869 0.837320 O\n0.792131 0.485319 0.162680 O\n0.485319 0.792131 0.162680 O\n0.228448 0.228448 0.287922 O\n0.771552 0.771552 0.712078 O\n0.149087 0.705328 0.367390 O\n0.705328 0.149087 0.367390 O\n0.850913 0.294672 0.632610 O\n0.294672 0.850913 0.632610 O\n0.422698 0.422698 0.407701 O\n0.577302 0.577302 0.592299 O\n",
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{
"id": "mp-1207531",
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"structure_string": "Zn12 B28 I4 O52\n1.0\n8.694260 0.000000 0.000000\n0.000000 8.696055 0.000000\n0.000000 0.000000 12.299677\nZn B I O\n12 28 4 52\ndirect\n0.260647 0.750850 0.116764 Zn\n0.739353 0.249150 0.616764 Zn\n0.760647 0.249150 0.116764 Zn\n0.239353 0.750850 0.616764 Zn\n0.511310 0.026692 0.344303 Zn\n0.488690 0.973308 0.844303 Zn\n0.011310 0.973308 0.344303 Zn\n0.988690 0.026692 0.844303 Zn\n0.011209 0.527144 0.341338 Zn\n0.988791 0.472856 0.841338 Zn\n0.511209 0.472856 0.341338 Zn\n0.488791 0.527144 0.841338 Zn\n0.094672 0.249837 0.022624 B\n0.905328 0.750163 0.522624 B\n0.594672 0.750163 0.022624 B\n0.405328 0.249837 0.522624 B\n0.245946 0.402737 0.174659 B\n0.754054 0.597263 0.674659 B\n0.745946 0.597263 0.174659 B\n0.254054 0.402737 0.674659 B\n0.045474 0.250649 0.494772 B\n0.954526 0.749351 0.994772 B\n0.545474 0.749351 0.494772 B\n0.454526 0.250649 0.994772 B\n0.243621 0.252917 0.347749 B\n0.756379 0.747083 0.847749 B\n0.743621 0.747083 0.347749 B\n0.256379 0.252917 0.847749 B\n0.501999 0.003222 0.095407 B\n0.498001 0.996778 0.595407 B\n0.001999 0.996778 0.095407 B\n0.998001 0.003222 0.595407 B\n0.246606 0.097520 0.175303 B\n0.753394 0.902480 0.675303 B\n0.746606 0.902480 0.175303 B\n0.253394 0.097520 0.675303 B\n0.001185 0.502162 0.094802 B\n0.998815 0.497838 0.594802 B\n0.501185 0.497838 0.094802 B\n0.498815 0.502162 0.594802 B\n0.738043 0.250053 0.339807 I\n0.261957 0.749947 0.839807 I\n0.238043 0.749947 0.339807 I\n0.761957 0.250053 0.839807 I\n0.165490 0.523867 0.116738 O\n0.834510 0.476133 0.616738 O\n0.665490 0.476133 0.116738 O\n0.334510 0.523867 0.616738 O\n0.049629 0.091349 0.002127 O\n0.950371 0.908651 0.502127 O\n0.549629 0.908651 0.002127 O\n0.450371 0.091349 0.502127 O\n0.357304 0.323558 0.421232 O\n0.642696 0.676442 0.921232 O\n0.857304 0.676442 0.421232 O\n0.142696 0.323558 0.921232 O\n0.231012 0.249594 0.106671 O\n0.768988 0.750406 0.606671 O\n0.731012 0.750406 0.106671 O\n0.268988 0.249594 0.606671 O\n0.173760 0.372861 0.280005 O\n0.826240 0.627139 0.780005 O\n0.673760 0.627139 0.280005 O\n0.326240 0.372861 0.780005 O\n0.836530 0.016034 0.115265 O\n0.163470 0.983966 0.615265 O\n0.336530 0.983966 0.115265 O\n0.663470 0.016034 0.615265 O\n0.117807 0.173442 0.410857 O\n0.882193 0.826558 0.910857 O\n0.617807 0.826558 0.410857 O\n0.382193 0.173442 0.910857 O\n0.319811 0.136246 0.278864 O\n0.680189 0.863754 0.778864 O\n0.819811 0.863754 0.278864 O\n0.180189 0.136246 0.778864 O\n0.037222 0.409398 0.492964 O\n0.962778 0.590602 0.992964 O\n0.537222 0.590602 0.492964 O\n0.462778 0.409398 0.992964 O\n0.468198 0.661769 0.072515 O\n0.531802 0.338231 0.572515 O\n0.968198 0.338231 0.072515 O\n0.031802 0.661769 0.572515 O\n0.408929 0.443297 0.188211 O\n0.591071 0.556703 0.688211 O\n0.908929 0.556703 0.188211 O\n0.091071 0.443297 0.688211 O\n0.089345 0.040823 0.192737 O\n0.910655 0.959177 0.692737 O\n0.589345 0.959177 0.192737 O\n0.410655 0.040823 0.692737 O\n0.541046 0.168765 0.069486 O\n0.458954 0.831235 0.569486 O\n0.041046 0.831235 0.069486 O\n0.958954 0.168765 0.569486 O\n",
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{
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{
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{
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"structure_string": "Ho6 Ga18\n1.0\n3.079146 -5.333238 0.000000\n3.079146 5.333238 0.000000\n0.000000 0.000000 14.220173\nHo Ga\n6 18\ndirect\n0.000000 0.000000 0.250000 Ho\n0.000000 0.000000 0.750000 Ho\n0.333333 0.666667 0.408434 Ho\n0.666667 0.333333 0.591566 Ho\n0.666667 0.333333 0.908434 Ho\n0.333333 0.666667 0.091566 Ho\n0.519902 0.480098 0.250000 Ga\n0.519902 0.039803 0.250000 Ga\n0.960197 0.480098 0.250000 Ga\n0.480098 0.519902 0.750000 Ga\n0.480098 0.960197 0.750000 Ga\n0.039803 0.519902 0.750000 Ga\n0.833487 0.166513 0.418424 Ga\n0.833487 0.666975 0.418424 Ga\n0.333025 0.166513 0.418424 Ga\n0.166513 0.833487 0.581576 Ga\n0.166513 0.333025 0.581576 Ga\n0.666975 0.833487 0.581576 Ga\n0.166513 0.833487 0.918424 Ga\n0.166513 0.333025 0.918424 Ga\n0.666975 0.833487 0.918424 Ga\n0.833487 0.166513 0.081576 Ga\n0.833487 0.666975 0.081576 Ga\n0.333025 0.166513 0.081576 Ga\n",
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}