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{
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"structure_string": "Ta4 Cr2 O12\n1.0\n4.741344 0.000000 -0.043736\n0.000000 4.741312 0.000000\n0.084462 0.000000 9.183306\nTa Cr O\n4 2 12\ndirect\n0.000000 0.000014 0.334794 Ta\n-0.000002 0.999987 0.665207 Ta\n0.500001 0.499988 0.834795 Ta\n0.499998 0.500014 0.165206 Ta\n0.499999 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.698246 0.698376 0.999997 O\n0.699113 0.699235 0.669065 O\n0.800886 0.199254 0.169065 O\n0.199114 0.800764 0.169065 O\n0.800884 0.199236 0.830935 O\n0.198247 0.801622 0.499997 O\n0.301753 0.301624 0.000003 O\n0.300887 0.300746 0.669065 O\n0.199113 0.800748 0.830936 O\n0.699111 0.699253 0.330934 O\n0.801752 0.198376 0.500003 O\n0.300885 0.300764 0.330934 O\n",
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{
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{
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"structure_string": "C6 F12\n1.0\n5.603261 -0.050305 -1.813350\n-0.635479 6.130816 -0.282103\n0.096338 -0.028546 6.390947\nC F\n6 12\ndirect\n0.551637 0.826847 0.771337 C\n0.448363 0.173154 0.228664 C\n0.343645 0.740824 0.629061 C\n0.656355 0.259177 0.370940 C\n0.248968 0.290003 0.099987 C\n0.751032 0.709998 0.900014 C\n0.275258 0.529416 0.578156 F\n0.181844 0.862891 0.522426 F\n0.598086 0.047425 0.807078 F\n0.049142 0.247051 0.165178 F\n0.184928 0.223308 0.882571 F\n0.815072 0.776693 0.117430 F\n0.950858 0.752950 0.834824 F\n0.818156 0.137110 0.477575 F\n0.724742 0.470585 0.421845 F\n0.692214 0.490480 0.876784 F\n0.307786 0.509521 0.123217 F\n0.401914 0.952575 0.192924 F\n",
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{
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"structure_string": "Mn6 O2 F10\n1.0\n-4.703769 4.703769 3.213362\n0.104038 4.820842 -3.232938\n-4.820842 -0.104038 -3.232938\nMn O F\n6 2 10\ndirect\n0.844886 0.672705 0.672705 Mn\n0.652973 0.342045 0.342045 Mn\n0.318145 0.656562 0.656562 Mn\n0.175082 0.339030 0.339030 Mn\n0.496745 0.998469 0.998469 Mn\n0.997255 0.984435 0.984435 Mn\n0.048299 0.756202 0.756202 O\n0.363367 0.444908 0.444908 O\n0.677085 0.637782 0.035574 F\n0.336074 0.976460 0.360988 F\n0.700186 0.105099 0.105099 F\n0.968860 0.228787 0.228787 F\n0.677085 0.035574 0.637782 F\n0.309492 0.879475 0.879475 F\n0.336074 0.360988 0.976460 F\n0.989111 0.300054 0.695071 F\n0.620165 0.586354 0.586354 F\n0.989111 0.695071 0.300054 F\n",
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{
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"structure_string": "Dy10 Si6 B2\n1.0\n4.274543 -7.403725 -0.000000\n4.274543 7.403725 0.000000\n-0.000000 0.000000 6.325229\nDy Si B\n10 6 2\ndirect\n0.333333 0.666667 0.500000 Dy\n0.760406 -0.000000 0.250000 Dy\n0.239593 0.239593 0.250000 Dy\n0.239594 -0.000000 0.750000 Dy\n-0.000000 0.239594 0.750000 Dy\n-0.000000 0.760406 0.250000 Dy\n0.333333 0.666667 0.000000 Dy\n0.666667 0.333333 0.500000 Dy\n0.666667 0.333333 0.000000 Dy\n0.760406 0.760406 0.750000 Dy\n0.399008 0.399008 0.750000 Si\n-0.000000 0.600992 0.750000 Si\n0.600992 -0.000000 0.750000 Si\n0.600991 0.600991 0.250000 Si\n-0.000000 0.399008 0.250000 Si\n0.399008 -0.000000 0.250000 Si\n0.000000 0.000000 0.000000 B\n0.000000 0.000000 0.500000 B\n",
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{
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"created_at": "2022-09-04T14:35:58.043517Z",
"updated_at": "2022-09-04T14:35:58.043532Z",
"structure_string": "Mn6 O4 F8\n1.0\n5.635115 0.017362 -0.022964\n1.589077 5.488107 0.002178\n1.965535 1.460205 6.762554\nMn O F\n6 4 8\ndirect\n0.293304 0.332116 0.161103 Mn\n0.686392 0.639594 0.329586 Mn\n0.349787 0.354012 0.686028 Mn\n0.678476 0.663186 0.834452 Mn\n0.002707 0.023572 0.493807 Mn\n0.987445 -0.000847 0.999696 Mn\n0.967950 0.349481 0.327178 O\n0.591029 0.558609 0.626993 O\n0.775830 0.758889 0.038550 O\n0.209390 0.234326 0.966280 O\n0.306468 0.705631 0.989190 F\n0.386712 0.942794 0.337003 F\n0.041660 0.669207 0.662074 F\n0.098228 0.132681 0.694507 F\n0.409818 0.420660 0.369987 F\n0.917406 0.889053 0.301988 F\n0.633048 0.029555 0.668090 F\n0.664352 0.297491 0.013491 F\n",
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{
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"created_at": "2022-09-04T14:35:58.334909Z",
"updated_at": "2022-09-04T14:35:58.334926Z",
"structure_string": "V6 O7 F5\n1.0\n0.000000 4.657272 -0.006275\n9.020973 0.000000 0.000000\n0.000000 -0.213382 -4.644878\nV O F\n6 7 5\ndirect\n0.995844 0.825103 0.014609 V\n0.995844 0.174896 0.014609 V\n0.946076 0.500000 0.998706 V\n0.498315 0.000000 0.503718 V\n0.531150 0.680065 0.491271 V\n0.531150 0.319934 0.491271 V\n0.300042 0.164971 0.301639 O\n0.300042 0.835029 0.301639 O\n0.684261 0.500000 0.684401 O\n0.708901 0.836158 0.704661 O\n0.800105 0.665587 0.196742 O\n0.800105 0.334413 0.196742 O\n0.708901 0.163842 0.704661 O\n0.199241 0.664005 0.797446 F\n0.800659 0.000000 0.203455 F\n0.298863 0.500000 0.287956 F\n0.201258 0.000000 0.809021 F\n0.199241 0.335995 0.797446 F\n",
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{
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"created_at": "2022-09-04T14:35:54.805844Z",
"updated_at": "2022-09-04T14:35:54.805863Z",
"structure_string": "Cd1 Cu1 H8 Cl4 O4\n1.0\n3.997310 0.003544 -0.055713\n1.892523 6.717739 -0.186450\n1.076549 -0.101462 8.432669\nCd Cu H Cl O\n1 1 8 4 4\ndirect\n0.000000 0.000000 0.500000 Cd\n0.500000 -0.000000 0.000000 Cu\n0.883128 0.659603 0.879922 H\n0.663954 0.639357 0.047912 H\n0.580989 0.407162 0.207733 H\n0.722551 0.559983 0.305317 H\n0.336045 0.360642 0.952089 H\n0.277448 0.440017 0.694684 H\n0.116871 0.340397 0.120078 H\n0.419011 0.592838 0.792268 H\n0.075204 0.934200 0.189231 Cl\n0.369982 0.262324 0.475272 Cl\n0.630017 0.737676 0.524729 Cl\n0.924795 0.065799 0.810770 Cl\n0.743371 0.491649 0.200363 O\n0.350136 0.285080 0.053674 O\n0.256628 0.508351 0.799638 O\n0.649863 0.714920 0.946327 O\n",
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{
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"structure_string": "Sr6 Cu3 Cl3 O6\n1.0\n4.016601 0.000000 0.000000\n-2.008302 3.478480 -0.000000\n0.000000 -0.000000 27.634953\nSr Cu Cl O\n6 3 3 6\ndirect\n0.333078 0.999623 0.576606 Sr\n0.666544 0.666922 0.243273 Sr\n0.333456 0.000377 0.090061 Sr\n0.666923 0.666544 0.756727 Sr\n0.999622 0.333078 0.423394 Sr\n0.000378 0.333456 0.909939 Sr\n0.666869 0.666869 -0.000000 Cu\n0.333131 -0.000000 0.333333 Cu\n0.000000 0.333131 0.666667 Cu\n0.000000 0.333651 0.166667 Cl\n0.666349 0.666349 0.500000 Cl\n0.333651 -0.000000 0.833333 Cl\n0.666778 0.667024 0.065819 O\n0.999753 0.332976 0.600847 O\n0.667024 0.666777 0.934181 O\n0.332976 0.999753 0.399153 O\n0.000247 0.333223 0.732486 O\n0.333222 0.000247 0.267514 O\n",
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{
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"created_at": "2022-09-04T14:35:58.033138Z",
"updated_at": "2022-09-04T14:35:58.033150Z",
"structure_string": "K4 Sn2 Br12\n1.0\n7.548836 0.000000 0.000000\n0.000000 7.373200 -0.047778\n0.000000 -0.035262 10.489974\nK Sn Br\n4 2 12\ndirect\n0.437386 0.981725 0.251921 K\n0.062614 0.481725 0.751921 K\n0.937386 0.518275 0.248078 K\n0.562615 0.018275 0.748078 K\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 Sn\n0.701640 0.790292 0.462215 Br\n-0.002718 0.928927 0.752324 Br\n0.201640 0.709708 0.037785 Br\n0.298360 0.209708 0.537785 Br\n0.497282 0.571074 0.747675 Br\n0.002718 0.071074 0.247675 Br\n0.289533 0.199682 0.968984 Br\n0.710468 0.800319 0.031015 Br\n0.210467 0.699681 0.468984 Br\n0.502718 0.428927 0.252324 Br\n0.789533 0.300319 0.531015 Br\n0.798360 0.290292 0.962215 Br\n",
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{
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"created_at": "2022-09-04T14:35:48.197383Z",
"updated_at": "2022-09-04T14:35:48.197400Z",
"structure_string": "Ti1 V4 Cu1 O12\n1.0\n6.708773 -0.030057 -0.048453\n-0.744306 6.667425 0.048453\n-1.441591 1.295442 5.489391\nTi V Cu O\n1 4 1 12\ndirect\n0.916721 0.916721 0.250000 Ti\n0.198545 0.615300 0.751576 V\n0.391207 0.788985 0.266679 V\n0.615301 0.198545 0.748423 V\n0.788985 0.391207 0.233321 V\n0.095179 0.095179 0.750000 Cu\n0.816745 0.030569 0.887070 O\n0.628845 0.334644 0.443070 O\n0.636888 0.906350 0.278245 O\n0.640753 0.377410 0.939655 O\n0.334644 0.628845 0.056930 O\n0.201037 0.963061 0.173225 O\n0.377410 0.640753 0.560345 O\n0.906350 0.636888 0.221755 O\n0.072122 0.385628 0.761455 O\n0.030569 0.816745 0.612930 O\n0.385629 0.072122 0.738545 O\n0.963061 0.201037 0.326775 O\n",
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{
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"created_at": "2022-09-04T14:35:55.067626Z",
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"structure_string": "Cu2 I4 O12\n1.0\n5.022898 0.000000 -0.172639\n0.000000 6.279798 0.000000\n0.015831 0.000000 8.237380\nCu I O\n2 4 12\ndirect\n0.500000 0.500000 0.500000 Cu\n0.500000 0.000000 0.500000 Cu\n0.527178 0.750000 0.154448 I\n0.036866 0.250000 0.235311 I\n0.963135 0.750000 0.764689 I\n0.472822 0.250000 0.845552 I\n0.748930 0.966616 0.093175 O\n0.748930 0.533385 0.093175 O\n0.251070 0.033385 0.906825 O\n0.266010 0.471243 0.305795 O\n0.251070 0.466616 0.906825 O\n0.358263 0.250000 0.619595 O\n0.641737 0.750000 0.380405 O\n0.733990 0.528757 0.694205 O\n0.266010 0.028757 0.305795 O\n0.733990 0.971244 0.694205 O\n0.809495 0.250000 0.400082 O\n0.190505 0.750000 0.599918 O\n",
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]
}