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{
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{
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"structure_string": "Y2 Mg2 Ti2 S8\n1.0\n6.647544 0.000416 3.938287\n2.141239 6.118639 3.964786\n-0.011464 0.020991 7.598773\nY Mg Ti S\n2 2 2 8\ndirect\n0.500001 0.500001 0.499998 Y\n0.000002 0.499997 0.500001 Y\n0.878038 0.871957 0.871960 Mg\n0.121961 0.128045 0.128043 Mg\n0.500000 0.500003 0.999997 Ti\n0.500001 0.999997 0.500003 Ti\n0.723778 0.751889 0.751892 S\n0.267891 0.231238 0.732988 S\n0.267886 0.732991 0.231234 S\n0.727559 0.248109 0.248108 S\n0.732112 0.267011 0.768765 S\n0.272440 0.751892 0.751891 S\n0.276225 0.248110 0.248109 S\n0.732112 0.768761 0.267014 S\n",
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{
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"structure_string": "Tb4 Pb2 S8\n1.0\n6.957101 -0.012538 -2.452029\n-3.489409 6.018758 -2.452029\n0.007239 0.012538 7.376562\nTb Pb S\n4 2 8\ndirect\n0.118796 0.750001 0.868795 Tb\n0.250000 0.618796 0.368795 Tb\n0.381205 0.250000 0.631205 Tb\n0.750000 0.881205 0.131205 Tb\n0.625000 0.375000 0.250000 Pb\n0.875000 0.125000 0.750000 Pb\n0.013378 0.861485 0.496207 S\n0.138515 0.134723 0.151893 S\n0.361485 0.513378 0.996207 S\n0.634723 0.638516 0.651893 S\n0.486622 0.982830 0.848107 S\n0.482830 0.986623 0.348107 S\n0.865277 0.517170 0.003792 S\n0.017170 0.365278 0.503793 S\n",
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{
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"updated_at": "2022-09-04T14:38:54.987961Z",
"structure_string": "Bi8 O12\n1.0\n7.722295 0.000000 0.000000\n-3.861147 6.687704 0.000000\n-0.000000 -0.000000 5.983759\nBi O\n8 12\ndirect\n0.176251 0.352502 0.226432 Bi\n0.176251 0.823748 0.226432 Bi\n0.647496 0.823748 0.226432 Bi\n0.823747 0.647497 0.726432 Bi\n0.823748 0.176252 0.726432 Bi\n0.352502 0.176252 0.726432 Bi\n0.666666 0.333333 0.228588 Bi\n0.333333 0.666666 0.728588 Bi\n0.129133 0.258267 0.837448 O\n0.258267 0.129133 0.337447 O\n0.870866 0.129133 0.337447 O\n0.870866 0.741732 0.337447 O\n0.537266 0.074533 0.006267 O\n0.074533 0.537266 0.506267 O\n0.537266 0.462733 0.006267 O\n0.462733 0.925466 0.506267 O\n0.129133 0.870866 0.837448 O\n0.462733 0.537266 0.506267 O\n0.925466 0.462733 0.006267 O\n0.741732 0.870866 0.837448 O\n",
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{
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"created_at": "2022-09-04T14:37:02.068358Z",
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"structure_string": "Rb4 Co2 Se4\n1.0\n5.882893 -0.000000 -2.477461\n-1.286548 6.301213 -3.054993\n0.038026 0.015937 8.313681\nRb Co Se\n4 2 4\ndirect\n0.646201 0.813860 0.292404 Rb\n0.353799 0.186140 0.707596 Rb\n0.853798 0.521456 0.707596 Rb\n0.146202 0.478544 0.292404 Rb\n0.750000 0.000000 -0.000000 Co\n0.250000 0.000000 -0.000000 Co\n0.598703 0.277061 0.197406 Se\n0.901297 0.079655 0.802595 Se\n0.098703 0.920345 0.197406 Se\n0.401297 0.722939 0.802595 Se\n",
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{
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"created_at": "2022-09-04T14:38:35.254123Z",
"updated_at": "2022-09-04T14:38:35.254158Z",
"structure_string": "Sr4 Mg4 Ge4\n1.0\n4.601851 -0.000000 0.000000\n0.000000 7.823501 0.000000\n0.000000 0.000000 8.586106\nSr Mg Ge\n4 4 4\ndirect\n0.250000 0.015747 0.183137 Sr\n0.250000 0.515747 0.316863 Sr\n0.750000 0.484253 0.683137 Sr\n0.750000 0.984253 0.816863 Sr\n0.750000 0.357146 0.063144 Mg\n0.250000 0.642854 0.936856 Mg\n0.750000 0.857146 0.436856 Mg\n0.250000 0.142854 0.563145 Mg\n0.750000 0.221189 0.390249 Ge\n0.250000 0.278811 0.890249 Ge\n0.250000 0.778810 0.609751 Ge\n0.750000 0.721189 0.109751 Ge\n",
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{
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"created_at": "2022-09-04T14:37:07.866974Z",
"updated_at": "2022-09-04T14:37:07.866999Z",
"structure_string": "Li2 Sc2 I6\n1.0\n3.663264 -6.344959 -0.000000\n3.663264 6.344959 0.000000\n-0.000000 0.000000 6.649839\nLi Sc I\n2 2 6\ndirect\n0.666667 0.333332 0.500000 Li\n0.666667 0.333332 0.000000 Li\n0.000000 0.000000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.003500 0.337354 0.250000 I\n0.662645 0.666145 0.250000 I\n0.333854 -0.003500 0.250000 I\n0.003500 0.666145 0.750000 I\n0.662645 -0.003501 0.750000 I\n0.333854 0.337354 0.750000 I\n",
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{
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"updated_at": "2022-09-04T14:36:47.572950Z",
"structure_string": "H10 C16 N2 O4\n1.0\n4.012079 0.069107 0.197043\n1.677582 6.920680 1.567909\n0.395676 0.012248 11.201258\nH C N O\n10 16 2 4\ndirect\n0.190618 0.777453 0.043898 H\n0.620755 0.794175 0.308134 H\n0.337263 0.786959 0.688861 H\n0.130190 0.141051 0.643138 H\n0.691001 0.277217 0.544009 H\n0.387350 0.149949 0.259114 H\n0.888095 0.650218 0.759212 H\n0.836120 0.287102 0.188854 H\n0.629151 0.641179 0.143146 H\n0.121395 0.294440 0.808232 H\n0.221516 0.169644 0.445707 C\n0.505787 0.553947 0.539572 C\n0.478915 0.765812 0.501221 C\n0.351259 0.867428 0.594940 C\n0.509199 0.869592 0.381155 C\n0.378576 0.071364 0.353842 C\n0.227219 0.066495 0.568250 C\n0.025664 0.379376 0.416824 C\n0.850529 0.367591 0.094956 C\n0.978646 0.266011 0.001254 C\n0.009464 0.369828 0.881230 C\n0.878897 0.571604 0.853918 C\n0.726542 0.566661 0.068269 C\n0.721341 0.669852 0.945744 C\n0.525515 0.879588 0.916822 C\n0.005506 0.054145 0.039543 C\n0.237058 0.905618 0.995487 N\n0.737330 0.405383 0.495548 N\n0.102311 0.506722 0.335407 O\n0.602283 0.006911 0.835415 O\n0.799404 0.999541 0.119933 O\n0.299722 0.499402 0.619996 O\n",
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{
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{
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{
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