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{
"id": "mp-697556",
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"structure_string": "Cr2 Cd1 H14 N4 O8\n1.0\n3.081168 6.320426 0.000000\n-3.081168 6.320426 0.000000\n0.000000 2.538227 7.238458\nCr Cd H N O\n2 1 14 4 8\ndirect\n0.659030 0.659030 0.779584 Cr\n0.340970 0.340970 0.220416 Cr\n0.000000 0.000000 0.000000 Cd\n0.924185 0.924185 0.693416 H\n0.075815 0.075815 0.306585 H\n0.911052 0.179664 0.641298 H\n0.179664 0.911052 0.641298 H\n0.088948 0.820336 0.358702 H\n0.820336 0.088948 0.358702 H\n0.400621 0.400621 0.771476 H\n0.599379 0.599379 0.228524 H\n0.353344 0.353344 0.591398 H\n0.646656 0.646656 0.408602 H\n0.144586 0.413170 0.790717 H\n0.413170 0.144586 0.790717 H\n0.855414 0.586830 0.209283 H\n0.586830 0.855414 0.209283 H\n0.002710 0.002710 0.706892 N\n0.997290 0.997290 0.293108 N\n0.328582 0.328582 0.735410 N\n0.671418 0.671418 0.264590 N\n0.864390 0.419147 0.911710 O\n0.419147 0.864390 0.911710 O\n0.135610 0.580853 0.088290 O\n0.580853 0.135610 0.088290 O\n0.568649 0.568649 0.661785 O\n0.431351 0.431351 0.338215 O\n0.788369 0.788369 0.632747 O\n0.211631 0.211631 0.367253 O\n",
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{
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"structure_string": "Cr2 Cd1 H14 N4 O8\n1.0\n6.227838 0.000000 0.000000\n-3.007031 6.360974 0.000000\n-0.450440 -2.875564 7.321866\nCr Cd H N O\n2 1 14 4 8\ndirect\n0.324041 0.669809 0.777630 Cr\n0.675959 0.330191 0.222370 Cr\n0.000000 0.000000 0.000000 Cd\n0.771992 0.887846 0.651266 H\n0.228008 0.112154 0.348734 H\n0.025391 0.128008 0.689796 H\n0.974609 0.871992 0.310204 H\n0.034274 0.885480 0.640268 H\n0.965726 0.114520 0.359732 H\n0.411807 0.808640 0.237355 H\n0.588193 0.191360 0.762645 H\n0.349969 0.712314 0.409501 H\n0.650031 0.287686 0.590499 H\n0.153573 0.559567 0.200206 H\n0.846427 0.440433 0.799794 H\n0.423301 0.567007 0.223085 H\n0.576699 0.432993 0.776915 H\n0.954448 0.976730 0.710035 N\n0.045552 0.023270 0.289965 N\n0.335711 0.663994 0.268039 N\n0.664289 0.336006 0.731961 N\n0.575630 0.713460 0.907394 O\n0.424370 0.286540 0.092606 O\n0.129868 0.709957 0.906705 O\n0.870132 0.290043 0.093295 O\n0.400257 0.841417 0.658899 O\n0.599743 0.158583 0.341101 O\n0.188903 0.405181 0.635730 O\n0.811097 0.594819 0.364270 O\n",
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"formula_full": "Cr2 Cd1 H14 N4 O8",
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{
"id": "mp-1245802",
"created_at": "2022-09-04T14:42:56.854661Z",
"structure_string": "Cr4 Cd6 N8\n1.0\n7.961436 0.687497 -1.285681\n-5.380147 6.875179 0.000000\n-1.259015 -0.985237 5.624240\nCr Cd N\n4 6 8\ndirect\n0.512892 0.148155 0.521809 Cr\n0.487108 0.635264 0.978191 Cr\n0.487108 0.851845 0.478191 Cr\n0.512892 0.364736 0.021809 Cr\n0.987117 0.823885 0.978163 Cd\n0.012883 0.836768 0.521837 Cd\n0.012883 0.176115 0.021837 Cd\n0.987117 0.163232 0.478163 Cd\n0.000000 0.513699 0.750000 Cd\n0.000000 0.486301 0.250000 Cd\n0.278188 0.899503 0.386394 N\n0.721812 0.621315 0.113606 N\n0.721812 0.100497 0.613606 N\n0.278188 0.378685 0.886394 N\n0.523313 0.251623 0.789286 N\n0.476687 0.728310 0.710714 N\n0.476687 0.748377 0.210714 N\n0.523313 0.271690 0.289286 N\n",
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"formula_full": "Cr4 Cd6 N8",
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{
"id": "mp-699555",
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"structure_string": "Cr4 C26 S2 N6 O20 F10\n1.0\n6.468083 0.000000 0.000000\n-2.032817 11.928054 0.000000\n-1.603698 -0.899644 14.276516\nCr C S N O F\n4 26 2 6 20 10\ndirect\n0.520888 0.835013 0.310762 Cr\n0.887773 0.734953 0.909880 Cr\n0.479112 0.164987 0.689238 Cr\n0.112227 0.265047 0.090120 Cr\n0.163645 0.814668 0.896277 C\n0.724744 0.969996 0.311418 C\n0.232000 0.184580 0.189273 C\n0.682275 0.793030 0.420441 C\n0.015605 0.659006 0.008850 C\n0.330906 0.248819 0.765603 C\n0.641867 0.089716 0.612083 C\n0.690730 0.295583 0.691345 C\n0.159970 0.152384 0.000967 C\n0.968871 0.473136 0.696315 C\n0.625574 0.121923 0.800519 C\n0.381353 0.351590 0.075634 C\n0.768000 0.815420 0.810727 C\n0.984395 0.340994 0.991150 C\n0.374426 0.878077 0.199481 C\n0.669094 0.751181 0.234397 C\n0.840030 0.847616 0.999033 C\n0.317725 0.206970 0.579559 C\n0.921804 0.623516 0.818125 C\n0.309270 0.704417 0.308655 C\n0.078196 0.376484 0.181875 C\n0.275256 0.030004 0.688582 C\n0.618647 0.648410 0.924366 C\n0.031129 0.526864 0.303685 C\n0.836355 0.185332 0.103723 C\n0.358133 0.910284 0.387917 C\n0.705438 0.413847 0.374348 S\n0.294562 0.586153 0.625652 S\n0.940807 0.555227 0.758328 N\n0.110411 0.472967 0.638771 N\n0.889589 0.527033 0.361229 N\n0.826001 0.376679 0.695214 N\n0.173999 0.623321 0.304786 N\n0.059193 0.444773 0.241672 N\n0.286508 0.902385 0.130748 O\n0.247887 0.303216 0.813151 O\n0.698630 0.863677 0.750544 O\n0.256486 0.953468 0.434814 O\n0.191599 0.084713 0.947333 O\n0.713492 0.097615 0.869252 O\n0.094659 0.614479 0.069400 O\n0.456311 0.595218 0.933754 O\n0.808401 0.915287 0.052667 O\n0.543689 0.404782 0.066246 O\n0.743514 0.046532 0.565186 O\n0.752113 0.696784 0.186849 O\n0.301370 0.136323 0.249456 O\n0.333651 0.859636 0.888999 O\n0.215369 0.229792 0.514620 O\n0.784631 0.770208 0.485380 O\n0.155028 0.947477 0.689225 O\n0.844972 0.052523 0.310775 O\n0.666349 0.140364 0.111001 O\n0.905341 0.385521 0.930600 O\n0.256104 0.558971 0.514050 F\n0.350394 0.623155 0.737532 F\n0.649606 0.376845 0.262468 F\n0.525682 0.492987 0.364578 F\n0.126610 0.672101 0.616589 F\n0.743896 0.441029 0.485950 F\n0.873390 0.327899 0.383411 F\n0.521960 0.310514 0.392005 F\n0.474318 0.507013 0.635422 F\n0.478040 0.689486 0.607995 F\n",
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"formula_full": "Cr4 C26 S2 N6 O20 F10",
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{
"id": "mp-1226378",
"created_at": "2022-09-04T14:39:31.995054Z",
"structure_string": "Cr2 C1\n1.0\n1.416545 -2.453527 0.000000\n1.416545 2.453527 0.000000\n0.000000 0.000000 4.258797\nCr C\n2 1\ndirect\n0.666667 0.333333 0.247532 Cr\n0.333333 0.666667 0.752468 Cr\n0.000000 0.000000 0.500000 C\n",
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{
"id": "mp-1226102",
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"structure_string": "Cr4 B6 W6\n1.0\n5.776505 0.000000 0.000000\n0.000000 5.776505 0.000000\n2.888253 2.888253 5.287746\nCr B W\n4 6 6\ndirect\n0.305505 0.805505 0.713781 Cr\n0.980714 0.480714 0.713781 Cr\n0.480714 0.305505 0.713781 Cr\n0.805505 0.980714 0.713781 Cr\n0.389140 0.889140 0.989961 B\n0.620899 0.120899 0.989961 B\n0.120899 0.389140 0.989961 B\n0.889140 0.620899 0.989961 B\n0.739937 0.739937 0.520126 B\n0.239937 0.239937 0.520126 B\n0.679090 0.179090 0.299666 W\n0.021244 0.521244 0.299666 W\n0.521244 0.679090 0.299666 W\n0.179090 0.021244 0.299666 W\n0.513471 0.513471 0.973058 W\n0.013471 0.013471 0.973058 W\n",
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{
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"structure_string": "Cr4 B2 P6 O24\n1.0\n4.043003 -7.002687 0.000000\n4.043003 7.002687 0.000000\n0.000000 0.000000 7.527778\nCr B P O\n4 2 6 24\ndirect\n0.666667 0.333333 0.561688 Cr\n0.333333 0.666667 0.438312 Cr\n0.333333 0.666667 0.061688 Cr\n0.666667 0.333333 0.938312 Cr\n0.000000 0.000000 0.750000 B\n0.000000 0.000000 0.250000 B\n0.685274 0.049570 0.250000 P\n0.049570 0.364296 0.750000 P\n0.314726 0.950430 0.750000 P\n0.635704 0.685274 0.750000 P\n0.950430 0.635704 0.250000 P\n0.364296 0.314726 0.250000 P\n0.863303 0.811096 0.750000 O\n0.947793 0.136697 0.750000 O\n0.272458 0.836406 0.924974 O\n0.163594 0.436052 0.924974 O\n0.811096 0.947793 0.250000 O\n0.436052 0.272458 0.424974 O\n0.163594 0.436052 0.575026 O\n0.396366 0.522436 0.250000 O\n0.436052 0.272458 0.075026 O\n0.563948 0.727542 0.575026 O\n0.477564 0.873930 0.250000 O\n0.873930 0.396366 0.750000 O\n0.522436 0.126070 0.750000 O\n0.272458 0.836406 0.575026 O\n0.836406 0.563948 0.424974 O\n0.836406 0.563948 0.075026 O\n0.052207 0.863303 0.250000 O\n0.188904 0.052207 0.750000 O\n0.563948 0.727542 0.924974 O\n0.727542 0.163594 0.424974 O\n0.603634 0.477564 0.750000 O\n0.126070 0.603634 0.250000 O\n0.136697 0.188904 0.250000 O\n0.727542 0.163594 0.075026 O\n",
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{
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"structure_string": "Cr8 Bi12 O44\n1.0\n5.640431 0.000000 -0.273168\n0.000000 12.379692 0.000000\n0.037927 0.000000 14.188699\nCr Bi O\n8 12 44\ndirect\n0.837122 0.122815 0.392338 Cr\n0.662878 0.622815 0.607662 Cr\n0.162878 0.877185 0.607662 Cr\n0.337122 0.377185 0.392338 Cr\n0.663850 0.408201 0.827656 Cr\n0.836150 0.908201 0.172344 Cr\n0.336150 0.591799 0.172344 Cr\n0.163850 0.091799 0.827656 Cr\n0.668657 0.123788 0.001895 Bi\n0.831343 0.623788 0.998105 Bi\n0.331343 0.876212 0.998105 Bi\n0.168657 0.376212 0.001895 Bi\n0.756518 0.856877 0.816347 Bi\n0.743482 0.356877 0.183653 Bi\n0.243482 0.143123 0.183653 Bi\n0.256518 0.643123 0.816347 Bi\n0.831251 0.351954 0.575335 Bi\n0.668749 0.851954 0.424665 Bi\n0.168749 0.648046 0.424665 Bi\n0.331251 0.148046 0.575335 Bi\n0.406672 0.359882 0.797222 O\n0.093328 0.859882 0.202778 O\n0.593328 0.640118 0.202778 O\n0.906672 0.140118 0.797222 O\n0.617654 0.958190 0.928926 O\n0.882346 0.458190 0.071074 O\n0.382346 0.041810 0.071074 O\n0.117654 0.541810 0.928926 O\n0.315765 0.312919 0.288720 O\n0.184235 0.812919 0.711280 O\n0.684235 0.687081 0.711280 O\n0.815765 0.187081 0.288720 O\n0.513173 0.243757 0.107981 O\n0.986827 0.743757 0.892019 O\n0.486827 0.756243 0.892019 O\n0.013173 0.256243 0.107981 O\n0.076078 0.426126 0.423980 O\n0.423922 0.926126 0.576020 O\n0.923922 0.573874 0.576020 O\n0.576078 0.073874 0.423980 O\n0.167086 0.582172 0.265398 O\n0.332914 0.082172 0.734602 O\n0.832914 0.417828 0.734602 O\n0.667086 0.917828 0.265398 O\n0.476570 0.522082 0.612611 O\n0.023430 0.022082 0.387389 O\n0.523430 0.477918 0.387389 O\n0.976570 0.977918 0.612611 O\n0.845527 0.716175 0.362893 O\n0.654473 0.216174 0.637107 O\n0.154473 0.283826 0.637107 O\n0.345527 0.783825 0.362893 O\n0.543784 0.708029 0.523506 O\n0.956216 0.208029 0.476494 O\n0.456216 0.291971 0.476494 O\n0.043784 0.791971 0.523506 O\n0.893679 0.035077 0.125245 O\n0.606321 0.535077 0.874755 O\n0.106321 0.964923 0.874755 O\n0.393679 0.464923 0.125245 O\n0.294839 0.169230 0.912447 O\n0.205161 0.669230 0.087553 O\n0.705161 0.830770 0.087553 O\n0.794839 0.330770 0.912447 O\n",
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