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{
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"structure_string": "Pr4 B4 O12\n1.0\n5.101060 0.000000 0.000000\n-0.000000 5.790404 0.000000\n0.000000 0.000000 8.195594\nPr B O\n4 4 12\ndirect\n0.750000 0.757904 0.584724 Pr\n0.250000 0.742095 0.084724 Pr\n0.750000 0.257904 0.915276 Pr\n0.250000 0.242095 0.415276 Pr\n0.750000 0.916060 0.237680 B\n0.250000 0.583939 0.737679 B\n0.750000 0.416060 0.262320 B\n0.250000 0.083940 0.762320 B\n0.250000 0.600031 0.570401 O\n0.750000 0.899968 0.070401 O\n0.516717 0.912076 0.323034 O\n0.483283 0.587923 0.823034 O\n0.983283 0.412076 0.176966 O\n0.016717 0.587923 0.823034 O\n0.483283 0.087924 0.676965 O\n0.516717 0.412076 0.176966 O\n0.750000 0.399969 0.429599 O\n0.983283 0.912076 0.323034 O\n0.016717 0.087924 0.676965 O\n0.250000 0.100031 0.929598 O\n",
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{
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"structure_string": "H8 C12 S2\n1.0\n3.953421 0.005556 0.598814\n0.139636 6.237265 0.388710\n-0.077077 0.020574 9.806654\nH C S\n8 12 2\ndirect\n0.317535 0.269624 0.150915 H\n0.688483 0.812180 0.030319 H\n0.241647 0.671392 0.605041 H\n0.159346 0.862554 0.836453 H\n0.254072 0.799966 0.083091 H\n0.831403 0.673626 0.484442 H\n0.778039 0.839313 0.256632 H\n0.385078 0.098472 0.380877 H\n0.476852 0.259593 0.351936 C\n0.440588 0.356642 0.222249 C\n0.609190 0.373260 0.450276 C\n0.544673 0.567320 0.186156 C\n0.720604 0.582340 0.412289 C\n0.691603 0.675787 0.282433 C\n0.439953 0.596922 0.925586 C\n0.481408 0.697233 0.056678 C\n0.523876 0.415509 0.702959 C\n0.336452 0.606860 0.697884 C\n0.289275 0.707938 0.822956 C\n0.638345 0.280995 0.591577 C\n0.628520 0.359066 0.869381 S\n0.817648 0.041679 0.618071 S\n",
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{
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"created_at": "2022-09-04T14:36:13.144204Z",
"updated_at": "2022-09-04T14:36:13.144222Z",
"structure_string": "Li4 Mn4 F12\n1.0\n5.404967 0.000728 -0.330634\n-2.731936 4.660973 -0.358852\n-0.749444 -1.255003 9.795086\nLi Mn F\n4 4 12\ndirect\n0.474629 0.714439 0.929549 Li\n0.286102 0.525953 0.570551 Li\n0.714527 0.454834 0.429698 Li\n0.544695 0.285000 0.070433 Li\n0.290405 0.708932 0.249937 Mn\n-0.041174 0.040668 0.250067 Mn\n0.041517 -0.040960 0.749937 Mn\n0.709891 0.290684 0.750070 Mn\n0.344181 0.444801 0.383857 F\n0.254462 0.007450 0.143974 F\n-0.093478 0.314483 0.132752 F\n0.439134 0.039032 0.883902 F\n0.684683 0.092873 0.367203 F\n0.111344 0.363349 0.855892 F\n0.637307 -0.110805 0.644052 F\n0.774362 0.681498 0.867246 F\n-0.008127 0.744914 0.355992 F\n0.319305 0.226177 0.632711 F\n0.961389 0.561139 0.616072 F\n0.554853 0.655346 0.116110 F\n",
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{
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"created_at": "2022-09-04T14:35:46.089109Z",
"updated_at": "2022-09-04T14:35:46.089118Z",
"structure_string": "Dy4 Ni4 B16\n1.0\n-3.772133 3.772133 4.252825\n3.772133 -3.772133 4.252825\n3.772133 3.772133 -4.252825\nDy Ni B\n4 4 16\ndirect\n0.250000 0.749999 0.500000 Dy\n0.749999 0.250000 0.500000 Dy\n0.204825 0.204825 0.000000 Dy\n0.795174 0.795174 0.000000 Dy\n0.499999 0.728591 0.228592 Ni\n0.728591 0.499999 0.228592 Ni\n0.271408 0.500000 0.771407 Ni\n0.500000 0.271408 0.771407 Ni\n0.887563 0.887563 0.469301 B\n0.418262 0.418262 0.530698 B\n0.418262 0.887563 0.000000 B\n0.887563 0.418262 0.000000 B\n0.274908 0.111283 0.386190 B\n0.581737 0.581737 0.469301 B\n0.112436 0.112436 0.530698 B\n0.888716 0.725091 0.613810 B\n0.111283 0.274908 0.386190 B\n0.274907 0.888716 0.163625 B\n0.725092 0.111283 0.836375 B\n0.111283 0.725092 0.836375 B\n0.888716 0.274907 0.163625 B\n0.725091 0.888716 0.613810 B\n0.581737 0.112436 0.000000 B\n0.112436 0.581737 0.000000 B\n",
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{
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"created_at": "2022-09-04T14:37:51.786219Z",
"updated_at": "2022-09-04T14:37:51.786242Z",
"structure_string": "Al8 C2 N6 O2\n1.0\n5.373088 0.048556 0.000000\n-1.975279 4.997070 -0.000000\n0.000000 0.000000 8.983015\nAl C N O\n8 2 6 2\ndirect\n0.594616 0.405385 0.592424 Al\n0.957854 0.042147 0.675595 Al\n0.042147 0.957854 0.175595 Al\n0.542021 0.899437 0.391621 Al\n0.100564 0.457980 0.391621 Al\n0.457980 0.100564 0.891621 Al\n0.899437 0.542021 0.891621 Al\n0.405384 0.594616 0.092423 Al\n0.195372 0.804628 0.004301 C\n0.804628 0.195373 0.504302 C\n0.825500 0.174501 0.839196 N\n0.836067 0.673272 0.706367 N\n0.174501 0.825499 0.339195 N\n0.326729 0.163934 0.706367 N\n0.673271 0.836067 0.206367 N\n0.163933 0.326729 0.206367 N\n0.568693 0.431308 0.978031 O\n0.431308 0.568693 0.478031 O\n",
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"structure_string": "Li4 V4 Sn2 O12\n1.0\n4.572360 0.000173 -2.564418\n0.001119 10.072924 0.000697\n0.023369 0.000128 5.242347\nLi V Sn O\n4 4 2 12\ndirect\n0.646334 0.750013 0.146143 Li\n0.853839 0.249988 0.353684 Li\n0.146139 0.750018 0.646350 Li\n0.353662 0.249984 0.853850 Li\n0.343126 -0.000001 0.656884 V\n0.156885 0.499998 0.843111 V\n0.843176 0.499997 0.156820 V\n0.656825 -0.000001 0.343183 V\n0.999971 0.000002 0.000025 Sn\n0.500025 0.500001 0.499965 Sn\n0.157998 0.391995 0.510650 O\n0.989352 0.891994 0.342116 O\n0.842051 0.608007 0.489287 O\n0.510708 0.391993 0.157946 O\n0.342065 0.891994 0.989409 O\n0.165706 0.606523 0.165631 O\n0.834361 0.393476 0.834285 O\n0.665744 0.893472 0.665807 O\n0.334206 0.106527 0.334269 O\n0.489345 0.608005 0.842000 O\n0.657889 0.108005 0.010655 O\n0.010598 0.108004 0.657940 O\n",
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"updated_at": "2022-09-04T14:38:51.602356Z",
"structure_string": "Ti2 Co6 O16\n1.0\n5.612082 -0.000000 0.000000\n-2.806041 4.860205 0.000000\n-0.000000 -0.000000 8.873403\nTi Co O\n2 6 16\ndirect\n0.333334 0.666667 0.494677 Ti\n0.666667 0.333334 0.994677 Ti\n0.167488 0.832514 0.213541 Co\n0.167487 0.334975 0.213541 Co\n0.665026 0.832514 0.213541 Co\n0.334974 0.167487 0.713540 Co\n0.832513 0.665026 0.713540 Co\n0.832513 0.167487 0.713540 Co\n0.836838 0.673676 0.101339 O\n0.666667 0.333334 0.605522 O\n0.517283 0.034567 0.832085 O\n0.517284 0.482717 0.832085 O\n0.673676 0.836839 0.601339 O\n0.326325 0.163162 0.101339 O\n0.482717 0.517284 0.332085 O\n0.000000 0.000000 0.316737 O\n0.163162 0.326325 0.601339 O\n0.000000 0.000000 0.816736 O\n0.965433 0.482717 0.832085 O\n0.333334 0.666667 0.105522 O\n0.034567 0.517284 0.332085 O\n0.163162 0.836839 0.601339 O\n0.482717 0.965434 0.332085 O\n0.836838 0.163162 0.101339 O\n",
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}