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{
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{
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"structure_string": "Cr2 N8 Cl4 O6\n1.0\n5.994407 0.000000 0.000000\n-1.117122 6.893784 0.000000\n-1.110965 -3.264418 9.474042\nCr N Cl O\n2 8 4 6\ndirect\n0.862669 0.958379 0.840043 Cr\n0.137331 0.041621 0.159957 Cr\n0.933431 0.490639 0.735812 N\n0.066569 0.509361 0.264188 N\n0.953800 0.391275 0.630166 N\n0.046200 0.608725 0.369834 N\n0.267480 0.864556 0.159202 N\n0.732520 0.135444 0.840798 N\n0.580278 0.740359 0.734223 N\n0.419722 0.259641 0.265777 N\n0.749336 0.020991 0.345965 Cl\n0.250664 0.979009 0.654035 Cl\n0.281389 0.336617 0.968929 Cl\n0.718611 0.663383 0.031071 Cl\n0.989073 0.881740 0.672404 O\n0.010927 0.118260 0.327596 O\n0.155621 0.104755 0.975402 O\n0.844379 0.895245 0.024598 O\n0.441463 0.609144 0.743273 O\n0.558537 0.390856 0.256727 O\n",
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},
{
"id": "mp-1229150",
"created_at": "2022-09-04T14:42:20.722974Z",
"structure_string": "Co3 Cu1 H56 S4 O44\n1.0\n-0.034531 6.508868 -0.024358\n-0.003172 -0.040874 10.983317\n13.625165 -0.056004 -3.774180\nCo Cu H S O\n3 1 56 4 44\ndirect\n0.500000 0.500000 0.000000 Co\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Cu\n0.011035 0.303820 0.578031 H\n0.519737 0.187657 0.422238 H\n0.988965 0.696180 0.421969 H\n0.480263 0.812343 0.577762 H\n0.618414 0.580357 0.351328 H\n0.111438 0.935029 0.649974 H\n0.381586 0.419643 0.648672 H\n0.888562 0.064971 0.350026 H\n0.311528 0.296401 0.882546 H\n0.814820 0.203195 0.117396 H\n0.688472 0.703599 0.117454 H\n0.185180 0.796805 0.882604 H\n0.915312 0.461572 0.298241 H\n0.401977 0.038785 0.713562 H\n0.084688 0.538428 0.701759 H\n0.598023 0.961215 0.286438 H\n0.255429 0.460434 0.146198 H\n0.756904 0.037312 0.852527 H\n0.744571 0.539566 0.853802 H\n0.243096 0.962688 0.147473 H\n0.439161 0.358534 0.125943 H\n0.937238 0.144305 0.875743 H\n0.560839 0.641466 0.874057 H\n0.062762 0.855695 0.124257 H\n0.542829 0.299900 0.844281 H\n0.046362 0.201166 0.156311 H\n0.457171 0.700100 0.155719 H\n0.953638 0.798834 0.843689 H\n0.761742 0.368235 0.334330 H\n0.252561 0.132537 0.676025 H\n0.238258 0.631765 0.665670 H\n0.747439 0.867463 0.323975 H\n0.270022 0.367825 0.370761 H\n0.759561 0.130734 0.626770 H\n0.729978 0.632175 0.629239 H\n0.240439 0.869266 0.373230 H\n0.355506 0.508781 0.410965 H\n0.842127 0.989034 0.589133 H\n0.644494 0.491219 0.589035 H\n0.157873 0.010966 0.410867 H\n0.878604 0.465364 0.089192 H\n0.377076 0.033723 0.912390 H\n0.121396 0.534636 0.910808 H\n0.622924 0.966277 0.087610 H\n0.413283 0.644020 0.321296 H\n0.914534 0.860842 0.679887 H\n0.586717 0.355980 0.678704 H\n0.085466 0.139158 0.320113 H\n0.886376 0.377782 0.980252 H\n0.385742 0.124827 0.020415 H\n0.113624 0.622218 0.019748 H\n0.614258 0.875173 0.979585 H\n0.973662 0.243286 0.464308 H\n0.475269 0.248551 0.535834 H\n0.026338 0.756714 0.535692 H\n0.524731 0.751449 0.464166 H\n0.034725 0.673661 0.227147 S\n0.533700 0.824477 0.772903 S\n0.965275 0.326339 0.772853 S\n0.466300 0.175523 0.227097 S\n0.947410 0.320760 0.519091 O\n0.449647 0.170978 0.479688 O\n0.052590 0.679240 0.480909 O\n0.550353 0.829022 0.520312 O\n0.893224 0.725214 0.310062 O\n0.392165 0.773405 0.688156 O\n0.106776 0.274786 0.689938 O\n0.607835 0.226595 0.311844 O\n0.274315 0.440683 0.429088 O\n0.766363 0.058068 0.568270 O\n0.725685 0.559317 0.570912 O\n0.233637 0.941932 0.431730 O\n0.249457 0.721643 0.255163 O\n0.747802 0.779003 0.746309 O\n0.750543 0.278357 0.744837 O\n0.252198 0.220997 0.253691 O\n0.393810 0.441221 0.118069 O\n0.893446 0.061080 0.883658 O\n0.606190 0.558779 0.881931 O\n0.106554 0.938920 0.116342 O\n0.456024 0.317413 0.903060 O\n0.958655 0.184556 0.096962 O\n0.543976 0.682587 0.096940 O\n0.041345 0.815444 0.903038 O\n0.836389 0.450419 0.354947 O\n0.315928 0.047938 0.657989 O\n0.163611 0.549581 0.645053 O\n0.684072 0.952062 0.342011 O\n0.795724 0.430980 0.029211 O\n0.294773 0.069431 0.971302 O\n0.204276 0.569020 0.970789 O\n0.705227 0.930569 0.028698 O\n0.487572 0.620874 0.375488 O\n0.981605 0.887610 0.626100 O\n0.512428 0.379126 0.624512 O\n0.018395 0.112390 0.373900 O\n0.029936 0.531670 0.202878 O\n0.530723 0.966643 0.799598 O\n0.970064 0.468330 0.797122 O\n0.469277 0.033357 0.200402 O\n0.967409 0.713356 0.138424 O\n0.465302 0.782476 0.860163 O\n0.032591 0.286644 0.861576 O\n0.534698 0.217524 0.139837 O\n",
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{
"id": "mp-1182809",
"created_at": "2022-09-04T14:44:13.801366Z",
"structure_string": "Cs4\n1.0\n5.348822 0.000000 0.000000\n0.000000 9.093349 0.000000\n0.000000 0.000000 9.428690\nCs\n4\ndirect\n0.756036 0.408856 0.750000 Cs\n0.243964 0.591144 0.250000 Cs\n0.756036 0.091144 0.250000 Cs\n0.243964 0.908856 0.750000 Cs\n",
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{
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"updated_at": "2021-11-28T01:36:42.337000Z",
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},
{
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