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{
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"structure_string": "K2 Ca1\n1.0\n0.000000 4.859869 4.859869\n4.859869 0.000000 4.859869\n4.859869 4.859869 0.000000\nCa K\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n",
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{
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"structure_string": "B2 H12 N2\n1.0\n5.076807 0.000000 0.000000\n0.000000 4.835341 0.000000\n0.000000 0.000000 4.879203\nB H N\n2 12 2\ndirect\n0.499999 0.790850 0.498040 B\n0.000000 0.209148 0.998038 B\n0.000000 0.424830 0.392906 H\n0.164550 0.128653 0.402455 H\n0.835450 0.128653 0.402455 H\n0.302034 0.679263 0.410303 H\n0.697964 0.679263 0.410303 H\n0.499999 0.036870 0.434512 H\n0.499999 0.575167 0.892908 H\n0.335449 0.871349 0.902455 H\n0.664552 0.871349 0.902455 H\n0.197965 0.320736 0.910302 H\n0.802034 0.320736 0.910302 H\n0.000000 0.963132 0.934511 H\n0.000000 0.224762 0.321630 N\n0.499999 0.775240 0.821630 N\n",
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{
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"structure_string": "K5 Mg1\n1.0\n8.048151 0.000000 0.000000\n-4.024076 6.969903 0.000000\n0.000000 0.000000 7.602265\nK Mg\n5 1\ndirect\n0.666667 0.333333 0.000000 K\n0.333333 0.666667 0.000000 K\n0.500000 0.000000 0.500000 K\n0.000000 0.500000 0.500000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Mg\n",
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{
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"structure_string": "Li5 B1\n1.0\n4.719039 0.000000 0.000000\n-2.359520 4.086808 0.000000\n0.000000 0.000000 4.575339\nB Li\n1 5\ndirect\n0.000000 0.000000 0.000000 B\n0.666667 0.333333 0.000000 Li\n0.333333 0.666667 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n",
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{
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"created_at": "2022-09-04T15:39:12.691918Z",
"updated_at": "2022-09-04T15:39:12.691945Z",
"structure_string": "Li1 Mg1\n1.0\n0.000000 3.116594 3.116594\n3.116594 0.000000 3.116594\n3.116594 3.116594 0.000000\nLi Mg\n1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.249999 0.249999 0.249999 Mg\n",
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{
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"structure_string": "Li8 H96 N32\n1.0\n-6.625475 6.625591 -6.625567\n6.625602 6.625646 6.625495\n6.625652 -6.625519 -6.625671\nH Li N\n96 8 32\ndirect\n0.373159 0.765423 0.005069 H\n0.556531 0.101853 0.013685 H\n0.795753 0.594903 0.034047 H\n0.588161 0.486327 0.042847 H\n0.943484 0.457150 0.045314 H\n0.101850 0.513682 0.056529 H\n0.261676 0.965926 0.060824 H\n0.486328 0.542849 0.088161 H\n0.814288 0.222591 0.089456 H\n0.777397 0.866862 0.091686 H\n0.534038 0.795754 0.094904 H\n0.056530 0.013685 0.101850 H\n0.234562 0.239675 0.107761 H\n0.892247 0.131914 0.126808 H\n0.392247 0.126807 0.131913 H\n0.410536 0.724832 0.133133 H\n0.275179 0.408316 0.185720 H\n0.939142 0.905095 0.200846 H\n0.238304 0.799152 0.204251 H\n0.314287 0.089458 0.222591 H\n0.633137 0.410540 0.224829 H\n0.107752 0.739665 0.234568 H\n0.204253 0.299153 0.238321 H\n0.734564 0.107757 0.239672 H\n0.868084 0.994913 0.260340 H\n0.060821 0.465922 0.261672 H\n0.505081 0.373170 0.265427 H\n0.185716 0.908315 0.275180 H\n0.866862 0.591687 0.277401 H\n0.594905 0.534050 0.295753 H\n0.704253 0.238316 0.299154 H\n0.222593 0.589456 0.314287 H\n0.591689 0.777400 0.366862 H\n0.994905 0.760338 0.368087 H\n0.005084 0.265427 0.373171 H\n0.131916 0.626799 0.392242 H\n0.911837 0.454689 0.398165 H\n0.700846 0.939144 0.405094 H\n0.775184 0.185721 0.408320 H\n0.133137 0.224829 0.410540 H\n0.454689 0.898166 0.411838 H\n0.905097 0.700848 0.439158 H\n0.457152 0.545315 0.443480 H\n0.411837 0.398163 0.454688 H\n0.443484 0.045313 0.457150 H\n0.560822 0.261673 0.465924 H\n0.088161 0.042842 0.486314 H\n0.760344 0.868087 0.494919 H\n0.265418 0.873156 0.505065 H\n0.601847 0.056527 0.513681 H\n0.094904 0.295751 0.534053 H\n0.986319 0.088161 0.542844 H\n0.957150 0.443483 0.545312 H\n0.013680 0.601844 0.556526 H\n0.465923 0.761672 0.560820 H\n0.042843 0.986316 0.588161 H\n0.722591 0.314286 0.589457 H\n0.366864 0.277399 0.591689 H\n0.295751 0.034038 0.594901 H\n0.513685 0.556530 0.601850 H\n0.739672 0.734561 0.607758 H\n0.631914 0.392246 0.626805 H\n0.626802 0.892242 0.631913 H\n0.224830 0.910534 0.633132 H\n0.908318 0.775180 0.685721 H\n0.405097 0.439152 0.700851 H\n0.299153 0.738311 0.704251 H\n0.589457 0.814287 0.722592 H\n0.910536 0.133134 0.724830 H\n0.239669 0.607754 0.734568 H\n0.799153 0.704253 0.738323 H\n0.607752 0.234569 0.739666 H\n0.494906 0.368085 0.760340 H\n0.965922 0.560823 0.761670 H\n0.873162 0.005072 0.765422 H\n0.408317 0.685717 0.775180 H\n0.091687 0.366860 0.777400 H\n0.034040 0.094903 0.795752 H\n0.738304 0.204251 0.799152 H\n0.089457 0.722594 0.814283 H\n0.277400 0.091690 0.866862 H\n0.260338 0.494908 0.868083 H\n0.765425 0.505074 0.873162 H\n0.126798 0.631920 0.892241 H\n0.954689 0.411838 0.898162 H\n0.439140 0.200847 0.905094 H\n0.685714 0.275180 0.908316 H\n0.724831 0.633135 0.910537 H\n0.398166 0.954691 0.911837 H\n0.200846 0.405093 0.939150 H\n0.045316 0.957153 0.943484 H\n0.898171 0.911840 0.954693 H\n0.545315 0.943483 0.957150 H\n0.761677 0.060826 0.965928 H\n0.542847 0.588162 0.986323 H\n0.368086 0.260343 0.994919 H\n0.000000 0.746773 0.000000 Li\n0.000000 0.246771 0.000000 Li\n0.500003 0.000000 0.246773 Li\n0.753228 0.753229 0.253228 Li\n0.746773 0.500002 0.500003 Li\n0.246773 0.500002 0.500003 Li\n0.500000 0.000000 0.746770 Li\n0.253225 0.253225 0.753227 Li\n0.000000 0.426848 0.000000 N\n0.850765 0.156001 0.049751 N\n0.573140 0.573140 0.073145 N\n0.450328 0.801028 0.106302 N\n0.198982 0.305216 0.149239 N\n0.350769 0.049754 0.156000 N\n0.844025 0.893722 0.194749 N\n0.149261 0.805231 0.198977 N\n0.606289 0.450312 0.301028 N\n0.698978 0.149246 0.305221 N\n0.893735 0.694761 0.344017 N\n0.156001 0.549764 0.350777 N\n0.694738 0.844022 0.393710 N\n0.499985 0.000000 0.426848 N\n0.106286 0.301024 0.450304 N\n0.426843 0.499994 0.499985 N\n0.926852 0.499988 0.499999 N\n0.656001 0.350770 0.549755 N\n0.073145 0.073150 0.573149 N\n0.301024 0.950320 0.606297 N\n0.805218 0.698979 0.649239 N\n0.549763 0.850776 0.656000 N\n0.393737 0.344021 0.694764 N\n0.305228 0.649253 0.698979 N\n0.950318 0.106291 0.801027 N\n0.649254 0.198976 0.805225 N\n0.194745 0.393720 0.844015 N\n0.049770 0.656005 0.850779 N\n0.344024 0.194740 0.893713 N\n0.499994 0.000000 0.926842 N\n0.801027 0.606295 0.950309 N\n0.000000 0.926848 0.000000 N\n",
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{
"id": "oqmd-346216",
"created_at": "2022-09-04T14:51:07.841864Z",
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"structure_string": "Li1 H3\n1.0\n2.682636 0.000000 0.000000\n0.000000 2.682636 0.000000\n0.000000 0.000000 2.682636\nH Li\n3 1\ndirect\n0.499997 0.499997 0.000000 H\n0.499997 0.000000 0.499997 H\n0.000000 0.499997 0.499997 H\n0.000000 0.000000 0.000000 Li\n",
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{
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"structure_string": "Ca2 Cl4\n1.0\n4.234303 2.444676 6.914589\n-4.234303 2.444676 6.914589\n0.000000 -4.889352 6.914589\nCa Cl\n2 4\ndirect\n0.250000 0.250000 0.250000 Ca\n0.500000 0.500000 0.500000 Ca\n0.375000 0.375000 0.375000 Cl\n0.875001 0.375000 0.375000 Cl\n0.375000 0.875001 0.375000 Cl\n0.375000 0.375000 0.875001 Cl\n",
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{
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{
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"structure_string": "Rb4 Nb2\n1.0\n5.644469 3.258836 9.217380\n-5.644469 3.258836 9.217380\n0.000000 -6.517672 9.217380\nNb Rb\n2 4\ndirect\n0.250000 0.250000 0.250000 Nb\n0.500000 0.500000 0.500000 Nb\n0.875001 0.375000 0.375000 Rb\n0.375000 0.875001 0.375000 Rb\n0.375000 0.375000 0.375000 Rb\n0.375000 0.375000 0.875001 Rb\n",
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{
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"created_at": "2022-09-04T14:49:14.354694Z",
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"structure_string": "Li12 B6 H36 N6\n1.0\n-7.090676 4.093803 2.968581\n0.000000 -8.187607 2.968581\n7.090676 4.093803 2.968581\nB H Li N\n6 36 12 6\ndirect\n0.245660 0.650045 0.077498 B\n0.650044 0.077498 0.245660 B\n0.922503 0.754341 0.349956 B\n0.077498 0.245660 0.650044 B\n0.349956 0.922503 0.754341 B\n0.754341 0.349956 0.922503 B\n0.146589 0.487111 0.029475 H\n0.816926 0.312167 0.044094 H\n0.399385 0.667272 0.107420 H\n0.491906 0.438519 0.108452 H\n0.338288 0.282296 0.115243 H\n0.487111 0.029475 0.146590 H\n0.687833 0.955906 0.183074 H\n0.258572 0.755894 0.220019 H\n0.779982 0.741429 0.244106 H\n0.755894 0.220019 0.258572 H\n0.115242 0.338288 0.282296 H\n0.044094 0.816925 0.312167 H\n0.892580 0.600615 0.332728 H\n0.282296 0.115242 0.338288 H\n0.667271 0.107420 0.399385 H\n0.108452 0.491906 0.438519 H\n0.029475 0.146590 0.487111 H\n0.438520 0.108451 0.491905 H\n0.561480 0.891548 0.508094 H\n0.970525 0.853410 0.512889 H\n0.891547 0.508095 0.561480 H\n0.332729 0.892580 0.600614 H\n0.717704 0.884757 0.661712 H\n0.107419 0.399385 0.667271 H\n0.955906 0.183074 0.687832 H\n0.884757 0.661711 0.717704 H\n0.244106 0.779982 0.741429 H\n0.220018 0.258573 0.755894 H\n0.741429 0.244106 0.779982 H\n0.312167 0.044094 0.816926 H\n0.512889 0.970525 0.853409 H\n0.661712 0.717704 0.884757 H\n0.508094 0.561480 0.891548 H\n0.600615 0.332728 0.892580 H\n0.183074 0.687832 0.955906 H\n0.853410 0.512889 0.970525 H\n0.567036 0.214837 0.050707 Li\n0.050707 0.567036 0.214836 Li\n0.383783 0.566500 0.299379 Li\n0.566500 0.299378 0.383783 Li\n0.785164 0.949294 0.432965 Li\n0.700622 0.616219 0.433501 Li\n0.299379 0.383782 0.566500 Li\n0.214837 0.050706 0.567036 Li\n0.433501 0.700623 0.616218 Li\n0.616218 0.433501 0.700622 Li\n0.949294 0.432964 0.785164 Li\n0.432965 0.785164 0.949294 Li\n0.476465 0.380629 0.191952 N\n0.191953 0.476466 0.380628 N\n0.380629 0.191952 0.476466 N\n0.619372 0.808049 0.523535 N\n0.808048 0.523535 0.619372 N\n0.523535 0.619372 0.808049 N\n",
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{
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"structure_string": "Li8 Si1\n1.0\n8.348569 0.000000 0.000000\n-4.174284 7.230072 0.000000\n0.000000 0.000000 2.662189\nLi Si\n8 1\ndirect\n0.327273 0.163636 0.000000 Li\n0.836364 0.163636 0.000000 Li\n0.163636 0.327273 0.000000 Li\n0.666667 0.333333 0.000000 Li\n0.333333 0.666667 0.000000 Li\n0.836364 0.672727 0.000000 Li\n0.163636 0.836364 0.000000 Li\n0.672727 0.836364 0.000000 Li\n0.000000 0.000000 0.500000 Si\n",
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}
]
}