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{
"id": "mp-1216978",
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"structure_string": "Tm1 In7 Cu5\n1.0\n-2.810615 4.716638 4.726000\n2.810615 -4.716638 4.726000\n2.810615 4.716638 -4.726000\nTm In Cu\n1 7 5\ndirect\n0.998281 0.000000 0.998281 Tm\n0.341712 0.000000 0.341712 In\n0.666380 0.000000 0.666380 In\n0.672894 0.661279 0.011615 In\n0.350336 0.338721 0.011615 In\n0.226680 0.500000 0.726680 In\n0.185933 0.697990 0.487943 In\n0.789953 0.302010 0.487943 In\n0.503912 0.002207 0.995705 Cu\n0.503912 0.508207 0.501705 Cu\n0.993497 0.491793 0.995705 Cu\n0.993497 0.997793 0.501705 Cu\n0.773013 0.500000 0.273013 Cu\n",
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{
"id": "mp-1177824",
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"structure_string": "Li32 Ti13 Cr3 O48\n1.0\n5.087419 0.000000 0.000000\n-0.016889 8.845982 0.000000\n-1.586280 -2.914750 19.368627\nLi Ti Cr O\n32 13 3 48\ndirect\n0.987563 0.168698 0.249505 Li\n0.873888 0.375717 0.375181 Li\n0.751439 0.249453 0.999441 Li\n0.742057 0.920733 0.999870 Li\n0.988629 0.169867 0.750051 Li\n0.756029 0.578190 0.499178 Li\n0.874125 0.372969 0.874687 Li\n0.755648 0.249873 0.500169 Li\n0.738513 0.920499 0.500049 Li\n0.624785 0.124984 0.124937 Li\n0.759101 0.579507 0.999895 Li\n0.510083 0.331769 0.250541 Li\n0.623846 0.125561 0.625277 Li\n0.499159 0.000344 0.250220 Li\n0.487733 0.668851 0.250508 Li\n0.507428 0.328809 0.749375 Li\n0.374242 0.873764 0.374922 Li\n0.506159 0.999766 0.750178 Li\n0.251799 0.750168 0.000208 Li\n0.487922 0.669826 0.749688 Li\n0.240855 0.421325 0.000265 Li\n0.373555 0.875537 0.875202 Li\n0.260315 0.081322 0.500506 Li\n0.251177 0.749562 0.499806 Li\n0.125089 0.624999 0.125040 Li\n0.240698 0.420278 0.500316 Li\n0.011068 0.830682 0.249940 Li\n0.255576 0.077984 0.999214 Li\n0.124346 0.623526 0.624783 Li\n0.004342 0.499456 0.249995 Li\n0.010511 0.831656 0.750533 Li\n0.999761 0.499613 0.749742 Li\n0.871858 0.708589 0.373345 Ti\n0.879518 0.041301 0.374530 Ti\n0.880817 0.710876 0.877136 Ti\n0.626214 0.790861 0.125190 Ti\n0.624517 0.459021 0.125127 Ti\n0.630667 0.790499 0.624430 Ti\n0.622538 0.457792 0.623324 Ti\n0.379895 0.211452 0.377186 Ti\n0.380529 0.540690 0.874241 Ti\n0.371305 0.207927 0.873189 Ti\n0.124209 0.958950 0.125015 Ti\n0.126539 0.290563 0.124838 Ti\n0.130849 0.961059 0.627145 Ti\n0.870720 0.039964 0.874969 Cr\n0.371017 0.540240 0.375193 Cr\n0.121578 0.290249 0.625168 Cr\n0.962838 0.106038 0.068580 O\n0.928680 0.784490 0.068468 O\n0.928134 0.427130 0.067202 O\n0.965140 0.112499 0.569581 O\n0.821503 0.965513 0.181738 O\n0.822001 0.322954 0.182678 O\n0.927098 0.785792 0.568100 O\n0.924869 0.428850 0.567282 O\n0.786834 0.643702 0.181522 O\n0.713111 0.855832 0.318266 O\n0.821483 0.965753 0.681570 O\n0.830633 0.320937 0.681958 O\n0.674004 0.533148 0.319516 O\n0.677583 0.177317 0.317357 O\n0.783502 0.643514 0.681709 O\n0.714983 0.862458 0.819478 O\n0.462947 0.606122 0.068518 O\n0.568367 0.712237 0.430699 O\n0.571143 0.073610 0.432938 O\n0.676641 0.535865 0.817914 O\n0.674547 0.178683 0.817161 O\n0.428247 0.927360 0.067503 O\n0.428253 0.284338 0.068134 O\n0.540747 0.392487 0.431959 O\n0.463210 0.605666 0.568332 O\n0.571208 0.715695 0.931490 O\n0.580811 0.070895 0.931864 O\n0.321816 0.822811 0.182676 O\n0.321629 0.465435 0.181574 O\n0.427686 0.927301 0.567147 O\n0.424086 0.283064 0.569439 O\n0.533691 0.393408 0.931428 O\n0.286584 0.144196 0.181610 O\n0.215439 0.362208 0.319604 O\n0.321269 0.823781 0.682861 O\n0.318073 0.462246 0.680535 O\n0.174657 0.678671 0.317276 O\n0.177184 0.036034 0.318380 O\n0.290311 0.142471 0.681843 O\n0.212754 0.355679 0.818199 O\n0.080906 0.570960 0.431843 O\n0.071279 0.215819 0.431775 O\n0.177315 0.677190 0.817063 O\n0.173862 0.033029 0.819366 O\n0.033398 0.893492 0.431747 O\n0.070570 0.573438 0.932627 O\n0.068056 0.212160 0.930475 O\n0.040703 0.892401 0.931770 O\n",
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"formula_full": "Li32 Ti13 Cr3 O48",
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{
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"structure_string": "Zn8 Ga8 N8 O8\n1.0\n3.268786 -5.661703 0.000000\n3.268786 5.661703 0.000000\n0.000000 0.000000 10.554139\nZn Ga N O\n8 8 8 8\ndirect\n0.000000 0.000000 0.996511 Zn\n0.160698 0.321397 0.737637 Zn\n0.160698 0.839302 0.737637 Zn\n0.008240 0.504120 0.490176 Zn\n0.678603 0.839302 0.737637 Zn\n0.495880 0.991760 0.490176 Zn\n0.666667 0.333333 0.255131 Zn\n0.495880 0.504120 0.490176 Zn\n0.666667 0.333333 0.749213 Ga\n0.502449 0.004898 0.007338 Ga\n0.995102 0.497551 0.007338 Ga\n0.172750 0.345500 0.256185 Ga\n0.000000 0.000000 0.495791 Ga\n0.654500 0.827250 0.256185 Ga\n0.172750 0.827250 0.256185 Ga\n0.502449 0.497551 0.007338 Ga\n0.000000 0.000000 0.681994 N\n0.161343 0.838657 0.435167 N\n0.161343 0.322685 0.435167 N\n0.496294 0.503706 0.186460 N\n0.677315 0.838657 0.435167 N\n0.666667 0.333333 0.937475 N\n0.007412 0.503706 0.186460 N\n0.496294 0.992588 0.186460 N\n0.506730 0.493270 0.698222 O\n0.174217 0.825783 0.943893 O\n0.666667 0.333333 0.446379 O\n0.000000 0.000000 0.188254 O\n0.506730 0.013460 0.698222 O\n0.651566 0.825783 0.943893 O\n0.174217 0.348434 0.943893 O\n0.986540 0.493270 0.698222 O\n",
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{
"id": "mp-1195683",
"created_at": "2022-09-04T14:43:39.482299Z",
"structure_string": "Na10 Lu2 H8 C8 O28\n1.0\n7.645634 0.000000 0.000000\n0.000000 7.645634 0.000000\n0.000000 0.000000 11.670033\nNa Lu H C O\n10 2 8 8 28\ndirect\n0.000000 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.318660 0.823807 0.707758 Na\n0.818660 0.676193 0.792242 Na\n0.681340 0.176193 0.707758 Na\n0.181340 0.323807 0.792242 Na\n0.823807 0.681340 0.292242 Na\n0.676193 0.181340 0.207758 Na\n0.176193 0.318660 0.292242 Na\n0.323807 0.818660 0.207758 Na\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 Lu\n0.579007 0.934845 0.882971 H\n0.079007 0.565155 0.617029 H\n0.420993 0.065155 0.882971 H\n0.920993 0.434845 0.617029 H\n0.934845 0.420993 0.117029 H\n0.565155 0.920993 0.382971 H\n0.065155 0.579007 0.117029 H\n0.434845 0.079007 0.382971 H\n0.319910 0.215754 0.578072 C\n0.819910 0.284246 0.921928 C\n0.680090 0.784246 0.578072 C\n0.180090 0.715754 0.921928 C\n0.215754 0.680090 0.421928 C\n0.284246 0.180090 0.078072 C\n0.784246 0.319910 0.421928 C\n0.715754 0.819910 0.078072 C\n0.500000 0.000000 0.830800 O\n0.000000 0.500000 0.669200 O\n0.000000 0.500000 0.169200 O\n0.500000 0.000000 0.330800 O\n0.248858 0.664417 0.532868 O\n0.748858 0.835583 0.967132 O\n0.751142 0.335583 0.532868 O\n0.251142 0.164417 0.967132 O\n0.664417 0.751142 0.467132 O\n0.835583 0.251142 0.032868 O\n0.335583 0.248858 0.467132 O\n0.164417 0.748858 0.032868 O\n0.406503 0.323451 0.645727 O\n0.906503 0.176549 0.854273 O\n0.593497 0.676549 0.645727 O\n0.093497 0.823451 0.854273 O\n0.323451 0.593497 0.354273 O\n0.176549 0.093497 0.145727 O\n0.676549 0.406503 0.354273 O\n0.823451 0.906503 0.145727 O\n0.227346 0.092241 0.617649 O\n0.727346 0.407759 0.882351 O\n0.772654 0.907759 0.617649 O\n0.272654 0.592241 0.882351 O\n0.092241 0.772654 0.382351 O\n0.407759 0.272654 0.117649 O\n0.907759 0.227346 0.382351 O\n0.592241 0.727346 0.117649 O\n",
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{
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"structure_string": "Ce6 Cu2 Ge2 S14\n1.0\n5.098950 -8.831641 0.000000\n5.098950 8.831641 0.000000\n0.000000 0.000000 5.863652\nCe Cu Ge S\n6 2 2 14\ndirect\n0.770129 0.643415 0.250722 Ce\n0.356585 0.126714 0.250722 Ce\n0.126714 0.770129 0.750722 Ce\n0.643415 0.873286 0.750722 Ce\n0.873286 0.229871 0.250722 Ce\n0.229871 0.356585 0.750722 Ce\n0.000000 0.000000 0.223020 Cu\n0.000000 0.000000 0.723020 Cu\n0.666667 0.333333 0.831644 Ge\n0.333333 0.666667 0.331644 Ge\n0.666667 0.333333 0.454353 S\n0.519793 0.416944 0.986247 S\n0.250873 0.088996 0.735359 S\n0.583056 0.102849 0.986247 S\n0.749127 0.911004 0.235359 S\n0.911004 0.161877 0.735359 S\n0.088996 0.838123 0.235359 S\n0.838123 0.749127 0.735359 S\n0.333333 0.666667 0.954353 S\n0.161877 0.250873 0.235359 S\n0.102849 0.519793 0.486247 S\n0.480207 0.583056 0.486247 S\n0.897151 0.480207 0.986247 S\n0.416944 0.897151 0.486247 S\n",
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{
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"structure_string": "Sr6 Rh6 N10\n1.0\n6.329064 -0.351672 -0.468474\n-1.120843 7.765002 0.344047\n-2.604200 -2.809368 7.445830\nSr Rh N\n6 6 10\ndirect\n0.737510 0.406537 0.590520 Sr\n0.262490 0.593463 0.409480 Sr\n0.674514 0.847991 0.886499 Sr\n0.325486 0.152009 0.113501 Sr\n0.719003 0.680509 0.237367 Sr\n0.280997 0.319491 0.762633 Sr\n0.860906 0.345184 0.999186 Rh\n0.139094 0.654816 0.000814 Rh\n0.746190 0.990007 0.584696 Rh\n0.253810 0.009993 0.415304 Rh\n0.076438 0.810342 0.683880 Rh\n0.923562 0.189658 0.316120 Rh\n0.911299 0.148947 0.835245 N\n0.088701 0.851053 0.164755 N\n0.719631 0.729428 0.577632 N\n0.280369 0.270572 0.422368 N\n0.724918 0.513881 0.902062 N\n0.275082 0.486119 0.097938 N\n0.294683 0.958200 0.630216 N\n0.705317 0.041800 0.369784 N\n0.208601 0.638347 0.782317 N\n0.791399 0.361653 0.217683 N\n",
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{
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"structure_string": "Li2 V4 P8 H4 O32\n1.0\n4.900559 -7.926939 -0.003913\n4.851693 7.898870 0.011475\n3.016853 -0.001702 7.135766\nLi V P H O\n2 4 8 4 32\ndirect\n0.460190 0.092829 0.347614 Li\n0.042225 0.411492 0.652678 Li\n0.248557 0.249309 0.500377 V\n0.499307 0.997667 0.994885 V\n0.996545 0.500546 0.014775 V\n0.755121 0.753529 0.497194 V\n0.259686 0.606456 0.267791 P\n0.754702 0.104858 0.269112 P\n0.643656 0.498538 0.227588 P\n0.146012 0.000398 0.227337 P\n0.355662 0.506423 0.765455 P\n0.852178 0.005277 0.767702 P\n0.740585 0.396265 0.737936 P\n0.240571 0.893098 0.739728 P\n0.757494 0.266522 0.513818 H\n0.254097 0.762560 0.510682 H\n0.486422 0.495360 0.987764 H\n0.984850 0.991326 0.988507 H\n0.116687 0.064329 0.052485 O\n0.172435 0.118659 0.351362 O\n0.010693 0.185527 0.643642 O\n0.224207 0.050704 0.687175 O\n0.628979 0.076605 0.156489 O\n0.133494 0.577852 0.148675 O\n0.271830 0.444918 0.314497 O\n0.492415 0.316511 0.356953 O\n0.680789 0.135486 0.441223 O\n0.182967 0.628382 0.446731 O\n0.325640 0.382791 0.649417 O\n0.190787 0.517163 0.814386 O\n0.695247 0.024469 0.814606 O\n0.622509 0.567429 0.049067 O\n0.930148 0.268387 0.136313 O\n0.431409 0.764331 0.137739 O\n0.566702 0.238897 0.861770 O\n0.067607 0.727931 0.862361 O\n0.376719 0.433971 0.947512 O\n0.809792 0.481335 0.173786 O\n0.305122 0.981347 0.191567 O\n0.676279 0.617020 0.348606 O\n0.822833 0.372296 0.558013 O\n0.315132 0.871962 0.554190 O\n0.518271 0.680502 0.636534 O\n0.729873 0.559624 0.676355 O\n0.871581 0.424994 0.843558 O\n0.363854 0.916094 0.851921 O\n0.775119 0.946125 0.320405 O\n0.980636 0.822736 0.362611 O\n0.828274 0.885334 0.647130 O\n0.875649 0.929131 0.946445 O\n",
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