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{
"id": "mp-1228838",
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{
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{
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{
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{
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"structure_string": "Co4 Rh2 S8\n1.0\n-3.353048 3.382112 4.765744\n3.353048 -3.382112 4.765744\n3.353048 3.382112 -4.765744\nCo Rh S\n4 2 8\ndirect\n0.623759 0.873759 0.750000 Co\n0.376241 0.126241 0.250000 Co\n0.000000 0.000000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n0.240018 0.242364 0.502346 S\n0.765712 0.249338 0.516374 S\n0.240018 0.737672 0.997654 S\n0.232965 0.249338 0.983626 S\n0.767035 0.750662 0.016374 S\n0.759982 0.262328 0.002346 S\n0.234288 0.750662 0.483626 S\n0.759982 0.757636 0.497654 S\n",
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{
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"structure_string": "P4 H8 N4 F8\n1.0\n13.102799 0.000000 0.000000\n0.000000 4.964259 0.000000\n0.000000 2.276686 4.789510\nP H N F\n4 8 4 8\ndirect\n0.587818 0.361997 0.284168 P\n0.912182 0.861997 0.284168 P\n0.087818 0.138003 0.715832 P\n0.412182 0.638003 0.715832 P\n0.126526 0.346510 0.249118 H\n0.228409 0.375806 0.434974 H\n0.373474 0.846510 0.249118 H\n0.728409 0.124194 0.565026 H\n0.271591 0.875806 0.434974 H\n0.626526 0.153490 0.750882 H\n0.771591 0.624194 0.565026 H\n0.873474 0.653490 0.750882 H\n0.162904 0.260472 0.437671 N\n0.662904 0.239528 0.562329 N\n0.337096 0.760472 0.437671 N\n0.837096 0.739528 0.562329 N\n0.825941 0.036855 0.051639 F\n0.582939 0.076009 0.201995 F\n0.674059 0.536855 0.051639 F\n0.917061 0.576009 0.201995 F\n0.082939 0.423991 0.798005 F\n0.325941 0.463145 0.948361 F\n0.417061 0.923991 0.798005 F\n0.174059 0.963145 0.948361 F\n",
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{
"id": "mp-1195143",
"created_at": "2022-09-04T14:46:36.476124Z",
"structure_string": "Ba2 Ti2 Cu8 P8 O34\n1.0\n9.713672 0.000000 0.000000\n0.000000 9.713672 0.000000\n0.000000 0.000000 7.248581\nBa Ti Cu P O\n2 2 8 8 34\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Ba\n0.000000 0.500000 0.975295 Ti\n0.500000 0.000000 0.024705 Ti\n0.767628 0.512024 0.404584 Cu\n0.232372 0.487976 0.404584 Cu\n0.732372 0.012024 0.595416 Cu\n0.267628 0.987976 0.595416 Cu\n0.512024 0.767628 0.595416 Cu\n0.487976 0.232372 0.595416 Cu\n0.012024 0.732372 0.404584 Cu\n0.987976 0.267628 0.404584 Cu\n0.780767 0.307151 0.737615 P\n0.219233 0.692849 0.737615 P\n0.719233 0.807151 0.262385 P\n0.280767 0.192849 0.262385 P\n0.307151 0.780767 0.262385 P\n0.692849 0.219233 0.262385 P\n0.807151 0.719233 0.737615 P\n0.192849 0.280767 0.737615 P\n0.848996 0.364386 0.554701 O\n0.151004 0.635614 0.554701 O\n0.651004 0.864386 0.445299 O\n0.348996 0.135614 0.445299 O\n0.364386 0.848996 0.445299 O\n0.635614 0.151004 0.445299 O\n0.864386 0.651004 0.554701 O\n0.135614 0.348996 0.554701 O\n0.624537 0.337710 0.731837 O\n0.375463 0.662290 0.731837 O\n0.875463 0.837710 0.268163 O\n0.124537 0.162290 0.268163 O\n0.337710 0.624537 0.268163 O\n0.662290 0.375463 0.268163 O\n0.837710 0.875463 0.731837 O\n0.162290 0.124537 0.731837 O\n0.838537 0.386827 0.904030 O\n0.161463 0.613173 0.904030 O\n0.661463 0.886827 0.095970 O\n0.338537 0.113173 0.095970 O\n0.386827 0.838537 0.095970 O\n0.613173 0.161463 0.095970 O\n0.886827 0.661463 0.904030 O\n0.113173 0.338537 0.904030 O\n0.000000 0.500000 0.210293 O\n0.500000 0.000000 0.789707 O\n0.818009 0.152973 0.751972 O\n0.181991 0.847027 0.751972 O\n0.681991 0.652973 0.248028 O\n0.318009 0.347027 0.248028 O\n0.152973 0.818009 0.248028 O\n0.847027 0.181991 0.248028 O\n0.652973 0.681991 0.751972 O\n0.347027 0.318009 0.751972 O\n",
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{
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"structure_string": "Sr4 Ni4 O12\n1.0\n-2.741877 -2.752653 -3.896080\n-2.740235 2.754101 -3.898257\n8.333917 2.757364 -3.952549\nSr Ni O\n4 4 12\ndirect\n0.750020 0.374996 0.374965 Sr\n0.249569 0.625119 0.624628 Sr\n0.750069 0.874974 0.875069 Sr\n0.250429 0.124878 0.125386 Sr\n0.001265 0.749386 0.251919 Ni\n0.498800 0.000579 0.498145 Ni\n0.003848 0.248514 0.755892 Ni\n0.496058 0.501527 0.994015 Ni\n0.249995 0.875007 0.375023 O\n0.745008 0.124736 0.618375 O\n0.249950 0.375028 0.874987 O\n0.755070 0.625286 0.131614 O\n0.743415 0.629024 0.617702 O\n0.249950 0.875016 0.874986 O\n0.756664 0.120892 0.132294 O\n0.249973 0.375008 0.375019 O\n0.749971 0.875009 0.374981 O\n0.248322 0.125644 0.617812 O\n0.749928 0.375033 0.874969 O\n0.251696 0.624346 0.132217 O\n",
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{
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"structure_string": "Li5 Mn8 B8 O24\n1.0\n-5.276279 0.000000 0.000000\n-0.205541 -9.127637 0.000000\n2.484565 4.353787 10.272985\nLi Mn B O\n5 8 8 24\ndirect\n0.711551 0.747623 0.326818 Li\n0.461238 0.454761 0.070341 Li\n0.240345 0.261308 0.349202 Li\n0.225805 0.231737 0.611211 Li\n0.023125 0.991702 0.842520 Li\n0.970666 0.663088 0.115262 Mn\n0.976858 0.347348 0.869218 Mn\n0.744248 0.437841 0.372270 Mn\n0.745367 0.037381 0.614349 Mn\n0.479152 0.136942 0.121458 Mn\n0.531451 0.832656 0.866511 Mn\n0.259827 0.938229 0.372026 Mn\n0.222109 0.576993 0.619161 Mn\n0.969318 0.325829 0.126171 B\n0.775516 0.107602 0.380555 B\n0.735560 0.388340 0.625864 B\n0.454859 0.803216 0.114874 B\n0.513705 0.178816 0.874786 B\n0.249020 0.615061 0.373005 B\n0.261413 0.895621 0.637076 B\n0.031758 0.683776 0.862835 B\n0.017742 0.895452 0.655648 O\n0.723979 0.345139 0.154624 O\n0.867614 0.475575 0.578525 O\n0.889701 0.286861 0.678809 O\n0.588089 0.677903 0.128299 O\n0.539251 0.891800 0.051894 O\n0.956140 0.577907 0.910495 O\n0.908309 0.818581 0.874590 O\n0.673152 0.986827 0.408372 O\n0.605141 0.199137 0.330751 O\n0.762046 0.155534 0.843418 O\n0.501882 0.614535 0.366584 O\n0.475387 0.389799 0.614731 O\n0.239871 0.850999 0.166667 O\n0.434911 0.786722 0.671070 O\n0.349645 0.994523 0.585509 O\n0.142135 0.234846 0.166465 O\n0.046246 0.416300 0.059345 O\n0.412374 0.062407 0.907244 O\n0.379178 0.307720 0.876191 O\n0.150279 0.518781 0.427991 O\n0.075091 0.707690 0.326157 O\n0.252562 0.651884 0.808509 O\n0.040934 0.136374 0.406316 O\n",
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}