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{
"id": "mp-768735",
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"structure_string": "Ba8 Sr4 I24\n1.0\n9.774979 0.000000 0.000000\n0.000000 10.876276 0.000000\n0.000000 10.309645 15.426682\nBa Sr I\n8 4 24\ndirect\n0.711235 0.296524 0.091175 Ba\n0.898508 0.642347 0.713393 Ba\n0.398508 0.357653 0.786607 Ba\n0.211235 0.703476 0.408825 Ba\n0.788765 0.296524 0.591175 Ba\n0.601492 0.642347 0.213393 Ba\n0.101492 0.357653 0.286607 Ba\n0.288765 0.703476 0.908825 Ba\n0.650345 0.929100 0.426712 Sr\n0.150345 0.070900 0.073288 Sr\n0.849655 0.929100 0.926712 Sr\n0.349655 0.070900 0.573288 Sr\n0.328843 0.027637 0.410901 I\n0.262668 0.718680 0.707294 I\n0.611603 0.576368 0.864286 I\n0.956328 0.824345 0.488825 I\n0.056121 0.415941 0.925813 I\n0.040349 0.101246 0.226684 I\n0.540349 0.898754 0.273316 I\n0.456328 0.175655 0.011175 I\n0.556121 0.584059 0.574187 I\n0.111603 0.423632 0.635714 I\n0.762668 0.281320 0.792706 I\n0.828843 0.972363 0.089099 I\n0.171157 0.027637 0.910901 I\n0.237332 0.718680 0.207294 I\n0.888397 0.576368 0.364286 I\n0.443879 0.415941 0.425813 I\n0.543672 0.824345 0.988825 I\n0.459651 0.101246 0.726684 I\n0.959651 0.898754 0.773316 I\n0.943879 0.584059 0.074187 I\n0.043672 0.175655 0.511175 I\n0.388397 0.423632 0.135714 I\n0.737332 0.281320 0.292706 I\n0.671157 0.972363 0.589099 I\n",
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"spacegroup": 14
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{
"id": "mp-1020122",
"created_at": "2022-09-04T14:48:20.959188Z",
"structure_string": "Mg2 S4 O14\n1.0\n4.967835 0.000000 0.000000\n-1.963154 6.766322 0.000000\n-0.674092 -0.575659 8.314248\nMg S O\n2 4 14\ndirect\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.505462 0.646123 0.768370 S\n0.494538 0.353877 0.231630 S\n0.130884 0.250872 0.688513 S\n0.869116 0.749128 0.311487 S\n0.733040 0.562525 0.817137 O\n0.266960 0.437475 0.182863 O\n0.342086 0.680640 0.898029 O\n0.657914 0.319360 0.101971 O\n0.588831 0.810407 0.667548 O\n0.411169 0.189593 0.332452 O\n0.285049 0.478336 0.638813 O\n0.714951 0.521664 0.361187 O\n0.898154 0.192135 0.563403 O\n0.101846 0.807865 0.436597 O\n0.338872 0.142076 0.678502 O\n0.661128 0.857924 0.321498 O\n0.052261 0.271000 0.851195 O\n0.947739 0.729000 0.148805 O\n",
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},
{
"id": "mp-773085",
"created_at": "2022-09-04T14:39:05.154597Z",
"structure_string": "Li4 Co4 Sb4 O16\n1.0\n6.042143 -0.000001 -0.000024\n-0.000023 7.226386 5.110182\n-0.000018 -3.582088 5.065609\nLi Co Sb O\n4 4 4 16\ndirect\n0.250000 0.104439 0.000001 Li\n0.750000 0.604437 0.500001 Li\n0.750000 0.895562 0.999999 Li\n0.250001 0.395564 0.500000 Li\n0.999999 0.000000 0.500000 Co\n0.000001 0.500000 0.000000 Co\n0.499998 0.500001 0.000001 Co\n0.500000 0.000000 0.500001 Co\n0.749999 0.250001 0.250000 Sb\n0.250000 0.750000 0.749999 Sb\n0.749997 0.249999 0.750000 Sb\n0.250004 0.750001 0.250000 Sb\n0.523484 0.250222 0.999998 O\n0.023489 0.750225 0.499998 O\n0.976506 0.250223 0.000001 O\n0.476514 0.750221 0.499999 O\n0.023492 0.749776 0.999993 O\n0.523487 0.249778 0.500001 O\n0.476515 0.749780 0.000006 O\n0.976513 0.249774 0.500006 O\n0.749987 0.472958 0.230303 O\n0.250005 0.972960 0.730298 O\n0.750012 0.472961 0.769701 O\n0.249998 0.972962 0.269707 O\n0.250011 0.527038 0.769697 O\n0.749997 0.027041 0.269700 O\n0.249989 0.527037 0.230295 O\n0.750002 0.027039 0.730295 O\n",
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"formula_full": "Li4 Co4 Sb4 O16",
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},
{
"id": "mp-865188",
"created_at": "2022-09-04T14:48:31.316975Z",
"structure_string": "Mg1 H8 Cl2 O12\n1.0\n3.953183 5.676032 0.000000\n-3.953183 5.676032 0.000000\n0.000000 2.266349 5.556930\nMg H Cl O\n1 8 2 12\ndirect\n0.000000 0.000000 0.000000 Mg\n0.241337 0.042430 0.263297 H\n0.042430 0.241337 0.263297 H\n0.619482 0.281884 0.134727 H\n0.718116 0.380518 0.865273 H\n0.281884 0.619482 0.134727 H\n0.380518 0.718116 0.865273 H\n0.957570 0.758663 0.736703 H\n0.758663 0.957570 0.736703 H\n0.301923 0.301923 0.602748 Cl\n0.698077 0.698077 0.397252 Cl\n0.116186 0.116186 0.196163 O\n0.163123 0.163123 0.658760 O\n0.487914 0.186654 0.699310 O\n0.742730 0.257270 0.000000 O\n0.363903 0.363903 0.338098 O\n0.186654 0.487914 0.699310 O\n0.813346 0.512086 0.300690 O\n0.636097 0.636097 0.661902 O\n0.257270 0.742730 0.000000 O\n0.512086 0.813346 0.300690 O\n0.836877 0.836877 0.341240 O\n0.883814 0.883814 0.803837 O\n",
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{
"id": "mp-1200371",
"created_at": "2022-09-04T14:48:31.360399Z",
"structure_string": "Ag2 H72 S16 N22 O36\n1.0\n-6.783972 6.783972 8.100722\n6.783972 -6.783972 8.100722\n6.783972 6.783972 -8.100722\nAg H S N O\n2 72 16 22 36\ndirect\n0.750000 0.250000 0.500000 Ag\n0.000000 0.000000 0.000000 Ag\n0.223114 0.783698 0.434247 H\n0.400549 0.466302 0.939415 H\n0.349451 0.788866 0.565753 H\n0.526886 0.461134 0.060585 H\n0.211134 0.776886 0.560585 H\n0.533698 0.473114 0.934247 H\n0.216302 0.650549 0.439415 H\n0.538866 0.599451 0.065753 H\n0.976870 0.540419 0.560367 H\n0.769948 0.709581 0.936451 H\n0.980052 0.416503 0.439633 H\n0.773130 0.833497 0.063549 H\n0.583497 0.023130 0.563549 H\n0.290419 0.226870 0.060367 H\n0.459581 0.019948 0.436451 H\n0.166503 0.230052 0.939633 H\n0.987868 0.552657 0.438070 H\n0.635413 0.697343 0.935210 H\n0.114587 0.549797 0.561930 H\n0.762133 0.700203 0.064790 H\n0.450203 0.012133 0.564790 H\n0.302657 0.237868 0.938070 H\n0.447343 0.885413 0.435210 H\n0.299797 0.364587 0.061930 H\n0.817856 0.574653 0.750164 H\n0.925511 0.675347 0.743203 H\n0.824489 0.067692 0.249836 H\n0.932144 0.182308 0.256797 H\n0.932308 0.182144 0.756797 H\n0.324653 0.067856 0.250164 H\n0.425347 0.175511 0.243203 H\n0.817692 0.074489 0.749836 H\n0.957266 0.561338 0.772682 H\n0.961345 0.688662 0.895929 H\n0.788655 0.184584 0.227318 H\n0.792734 0.065416 0.104071 H\n0.815416 0.042734 0.604071 H\n0.311338 0.207266 0.272682 H\n0.438662 0.211345 0.395929 H\n0.934584 0.038655 0.727318 H\n0.994873 0.046772 0.479259 H\n0.182487 0.203228 0.448101 H\n0.567513 0.515613 0.520741 H\n0.755127 0.734387 0.551899 H\n0.484387 0.005127 0.051899 H\n0.796772 0.244873 0.979259 H\n0.953228 0.432487 0.948101 H\n0.265613 0.817513 0.020741 H\n0.923828 0.884817 0.385560 H\n0.250743 0.365183 0.539011 H\n0.499257 0.538268 0.614440 H\n0.826172 0.711732 0.460989 H\n0.461732 0.076172 0.960989 H\n0.634817 0.173828 0.885560 H\n0.115183 0.500743 0.039011 H\n0.288268 0.749257 0.114440 H\n0.079514 0.957186 0.449745 H\n0.242559 0.292814 0.622329 H\n0.507441 0.629769 0.550255 H\n0.670486 0.620231 0.377671 H\n0.370231 0.920486 0.877671 H\n0.707186 0.329514 0.949745 H\n0.042814 0.492559 0.122329 H\n0.379769 0.757441 0.050255 H\n0.031622 0.965990 0.560547 H\n0.344557 0.284010 0.565633 H\n0.405443 0.471076 0.439453 H\n0.718378 0.778924 0.434367 H\n0.528924 0.968378 0.934367 H\n0.715990 0.281622 0.060547 H\n0.034010 0.594557 0.065633 H\n0.221076 0.655443 0.939453 H\n0.971007 0.247011 0.546372 S\n0.049361 0.002989 0.223996 S\n0.700639 0.424635 0.453628 S\n0.778993 0.825365 0.776004 S\n0.575365 0.028993 0.276004 S\n0.997011 0.221007 0.046372 S\n0.752989 0.299361 0.723996 S\n0.174635 0.950639 0.953628 S\n0.099693 0.374178 0.755365 S\n0.131186 0.875822 0.225515 S\n0.618814 0.344329 0.244635 S\n0.650307 0.905671 0.774485 S\n0.655671 0.900307 0.274485 S\n0.124178 0.349693 0.255365 S\n0.625822 0.381186 0.725515 S\n0.094329 0.868814 0.744635 S\n0.250000 0.750000 0.500000 N\n0.500000 0.500000 0.000000 N\n0.014726 0.514726 0.500000 N\n0.735274 0.735274 0.000000 N\n0.485274 0.985274 0.500000 N\n0.264726 0.264726 0.000000 N\n0.914046 0.625000 0.789046 N\n0.835954 0.125000 0.210954 N\n0.875000 0.085954 0.710954 N\n0.375000 0.164046 0.289046 N\n0.007866 0.964068 0.469343 N\n0.255275 0.285932 0.543798 N\n0.494725 0.538523 0.530657 N\n0.742134 0.711477 0.456202 N\n0.461477 0.992134 0.956202 N\n0.714068 0.257866 0.969343 N\n0.035932 0.505275 0.043798 N\n0.288523 0.744725 0.030657 N\n0.378347 0.125000 0.753347 N\n0.371653 0.625000 0.246653 N\n0.375000 0.621653 0.746653 N\n0.875000 0.628347 0.253347 N\n0.415367 0.192928 0.881697 O\n0.438769 0.057072 0.722439 O\n0.311231 0.533670 0.118303 O\n0.334633 0.716330 0.277561 O\n0.466330 0.584633 0.777561 O\n0.942928 0.665367 0.381697 O\n0.807072 0.688769 0.222439 O\n0.283670 0.561231 0.618303 O\n0.286070 0.125000 0.661070 O\n0.463930 0.625000 0.338930 O\n0.375000 0.713930 0.838930 O\n0.875000 0.536070 0.161070 O\n0.088269 0.499663 0.794147 O\n0.044485 0.750337 0.088607 O\n0.705515 0.294122 0.205853 O\n0.661731 0.955878 0.911393 O\n0.705878 0.911731 0.411393 O\n0.249663 0.338269 0.294147 O\n0.500337 0.294485 0.588607 O\n0.044122 0.955515 0.705853 O\n0.230251 0.388563 0.784096 O\n0.145533 0.861437 0.341688 O\n0.604467 0.446155 0.215904 O\n0.519749 0.803845 0.658312 O\n0.553845 0.769749 0.158312 O\n0.138563 0.480251 0.284096 O\n0.611437 0.395533 0.841688 O\n0.196155 0.854467 0.715904 O\n0.068429 0.321962 0.830548 O\n0.258586 0.928038 0.246467 O\n0.491414 0.237881 0.169452 O\n0.681571 0.012119 0.753533 O\n0.762119 0.931571 0.253533 O\n0.071962 0.318429 0.330548 O\n0.678038 0.508586 0.746467 O\n0.987881 0.741414 0.669452 O\n",
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{
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{
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{
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}