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{
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"structure_string": "Mg1 Al2 Se4\n1.0\n-1.952752 -3.382265 -0.000000\n1.952752 -3.382265 -0.000000\n0.000000 -2.254844 12.916928\nMg Al Se\n1 2 4\ndirect\n0.832431 0.832431 0.502711 Mg\n0.069208 0.069208 0.792375 Al\n0.595650 0.595650 0.213055 Al\n0.956470 0.956470 0.130594 Se\n0.708389 0.708389 0.874834 Se\n0.536134 0.536134 0.391601 Se\n0.128723 0.128723 0.613830 Se\n",
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{
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"structure_string": "Na2 Ni2 As2 O8\n1.0\n4.802576 -0.002176 7.991028\n2.214882 4.261342 7.991028\n-0.003585 -0.002176 9.323156\nNa Ni As O\n2 2 2 8\ndirect\n0.713130 0.713127 0.713129 Na\n0.286872 0.286871 0.286872 Na\n0.835578 0.835574 0.835576 Ni\n0.164425 0.164424 0.164424 Ni\n0.433890 0.433888 0.433889 As\n0.566113 0.566110 0.566112 As\n0.463728 0.783729 0.115572 O\n0.536274 0.216269 0.884429 O\n0.115572 0.463727 0.783730 O\n0.783731 0.115570 0.463728 O\n0.370603 0.370602 0.370603 O\n0.216271 0.884428 0.536273 O\n0.629399 0.629396 0.629398 O\n0.884430 0.536271 0.216271 O\n",
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{
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"structure_string": "Li1 Ti1 O2\n1.0\n2.790038 0.000999 4.681173\n1.289971 2.473921 4.681175\n0.001648 0.000999 5.449560\nLi Ti O\n1 1 2\ndirect\n0.827935 0.827934 0.827932 Li\n0.001316 0.001316 0.001316 Ti\n0.591658 0.591658 0.591656 O\n0.412427 0.412427 0.412426 O\n",
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{
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"created_at": "2022-09-04T14:37:12.323074Z",
"updated_at": "2022-09-04T14:37:12.323090Z",
"structure_string": "Mg2 Cr4 O10\n1.0\n3.313289 0.000000 0.000000\n-0.000000 4.743006 0.000000\n0.000000 0.000000 11.476654\nMg Cr O\n2 4 10\ndirect\n0.750000 0.859704 0.250000 Mg\n0.249999 0.140296 0.750000 Mg\n0.249999 0.406333 0.100537 Cr\n0.750000 0.593666 0.899463 Cr\n0.750000 0.593666 0.600536 Cr\n0.249999 0.406333 0.399463 Cr\n0.750000 0.424560 0.750000 O\n0.249999 0.575440 0.250000 O\n0.750000 0.568766 0.071224 O\n0.249999 0.431235 0.928774 O\n0.750000 0.568766 0.428775 O\n0.249999 0.431235 0.571225 O\n0.249999 0.065752 0.361379 O\n0.750000 0.934250 0.638621 O\n0.750000 0.934250 0.861378 O\n0.249999 0.065752 0.138622 O\n",
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{
"id": "jvasp-48912",
"created_at": "2022-09-04T14:35:51.875977Z",
"updated_at": "2022-09-04T14:35:51.875996Z",
"structure_string": "Mg11 Mn2 O13\n1.0\n0.000000 -2.134193 -2.134193\n-2.133465 12.843276 -14.977470\n4.266931 -0.000000 0.000000\nMg Mn O\n11 2 13\ndirect\n0.921789 0.156419 0.078209 Mg\n0.614770 0.770456 0.385229 Mg\n0.538807 0.922386 0.461193 Mg\n0.770515 0.458966 0.229483 Mg\n0.846152 0.307692 0.153846 Mg\n0.384150 0.231699 0.615849 Mg\n0.460284 0.079431 0.539715 Mg\n0.308156 0.383687 0.691843 Mg\n0.232023 0.535954 0.767977 Mg\n0.153499 0.693000 0.846501 Mg\n0.077534 0.844929 0.922465 Mg\n0.999633 0.000730 0.000365 Mn\n0.692671 0.614654 0.307328 Mn\n0.615657 0.768682 0.884342 O\n0.458643 0.082712 0.041356 O\n0.308377 0.383246 0.191622 O\n0.383929 0.232139 0.116070 O\n0.233663 0.532673 0.266337 O\n0.151651 0.696697 0.348349 O\n0.076647 0.846703 0.423353 O\n0.769986 0.460024 0.730013 O\n0.922319 0.155361 0.577679 O\n0.846152 0.307692 0.653846 O\n0.692768 0.614461 0.807231 O\n0.999537 0.000925 0.500461 O\n0.540654 0.918688 0.959346 O\n",
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{
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"created_at": "2022-09-04T14:38:34.905712Z",
"updated_at": "2022-09-04T14:38:34.905739Z",
"structure_string": "Rb2 Fe4 S6\n1.0\n5.160601 0.000000 0.000000\n-0.000000 6.947192 -1.399395\n0.000000 -0.012196 7.086722\nRb Fe S\n2 4 6\ndirect\n0.250000 0.327819 0.672180 Rb\n0.750000 0.672180 0.327820 Rb\n0.000000 0.857818 0.857819 Fe\n0.000000 0.142181 0.142181 Fe\n0.500000 0.142181 0.142181 Fe\n0.500000 0.857818 0.857819 Fe\n0.750000 0.167930 0.383806 S\n0.250000 0.832069 0.616194 S\n0.250000 0.383806 0.167931 S\n0.750000 0.616193 0.832070 S\n0.750000 0.110774 0.889225 S\n0.250000 0.889225 0.110775 S\n",
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{
"id": "jvasp-117224",
"created_at": "2022-09-04T14:38:47.672822Z",
"updated_at": "2022-09-04T14:38:47.672859Z",
"structure_string": "Ca2 In4 S8\n1.0\n6.879528 -0.010975 -3.790207\n-2.291503 6.367718 -3.986838\n0.009785 0.010975 7.854520\nCa In S\n2 4 8\ndirect\n-0.000000 -0.000000 0.500000 Ca\n0.000000 0.500000 0.000000 Ca\n0.387931 0.637931 0.750000 In\n0.612069 0.362069 0.250000 In\n0.000000 0.000000 0.000000 In\n0.500000 0.000000 0.500000 In\n0.251842 0.767500 0.015658 S\n0.251841 0.236183 0.484341 S\n0.253386 0.761940 0.491446 S\n0.770494 0.761941 0.008554 S\n0.748158 0.232500 0.984341 S\n0.748159 0.763817 0.515658 S\n0.746614 0.238061 0.508553 S\n0.229506 0.238060 0.991446 S\n",
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{
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"created_at": "2022-09-04T14:37:19.314716Z",
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"structure_string": "Ca2 V3 O8\n1.0\n4.739230 -0.024394 -1.525509\n-0.876182 5.207472 -2.805266\n-0.030937 -0.014703 6.355201\nCa V O\n2 3 8\ndirect\n0.667668 0.729637 0.459271 Ca\n0.332332 0.270365 0.540728 Ca\n0.500000 0.999999 -0.000001 V\n0.999999 0.726851 -0.000000 V\n0.999999 0.273150 -0.000000 V\n0.040839 0.390968 0.781937 O\n0.959161 0.609032 0.218063 O\n0.095856 0.903437 0.806874 O\n0.904144 0.096563 0.193125 O\n0.393022 0.325003 0.204945 O\n0.393022 0.879944 0.204945 O\n0.606979 0.120056 0.795055 O\n0.606979 0.674998 0.795055 O\n",
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{
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"structure_string": "Ca1 Sn1 S2\n1.0\n4.080341 0.000000 -0.000000\n0.000000 4.080341 0.000000\n0.000000 0.000000 5.795034\nCa Sn S\n1 1 2\ndirect\n0.000000 0.000000 0.250170 Ca\n0.500000 0.500000 0.745642 Sn\n0.000000 0.000000 0.749278 S\n0.500000 0.500000 0.254909 S\n",
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"structure_string": "Ba4 Y2 Cl14\n1.0\n8.220531 4.057560 -0.311389\n-8.220531 4.057560 0.311389\n-5.916851 0.000000 8.161308\nBa Y Cl\n4 2 14\ndirect\n0.311084 0.680986 0.730778 Ba\n0.319014 0.688916 0.230777 Ba\n0.680986 0.311084 0.769222 Ba\n0.688916 0.319014 0.269222 Ba\n0.974875 0.974874 0.750000 Y\n0.025126 0.025126 0.250000 Y\n0.931888 0.760500 0.066608 Cl\n0.888811 0.634640 0.454928 Cl\n0.390788 0.390788 0.250000 Cl\n0.239500 0.068112 0.566608 Cl\n0.634640 0.888811 0.045072 Cl\n0.365360 0.111189 0.954928 Cl\n0.111189 0.365360 0.545072 Cl\n0.609212 0.609212 0.750000 Cl\n0.690978 0.069513 0.647570 Cl\n0.068112 0.239500 0.933393 Cl\n0.309022 0.930487 0.352430 Cl\n0.069513 0.690978 0.852430 Cl\n0.760500 0.931888 0.433393 Cl\n0.930487 0.309022 0.147570 Cl\n",
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{
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"structure_string": "Li2 Ti2 V3 O10\n1.0\n4.987602 0.006061 0.009087\n0.985969 5.002195 0.020025\n1.765634 1.587034 7.338505\nLi Ti V O\n2 2 3 10\ndirect\n0.534251 0.772589 0.399918 Li\n0.465747 0.227408 0.600084 Li\n0.005914 0.873399 0.684834 Ti\n0.994085 0.126598 0.315167 Ti\n0.500000 -0.000000 0.000000 V\n0.959778 0.315055 0.896033 V\n0.040221 0.684942 0.103968 V\n0.226870 0.324438 0.060149 O\n0.725575 0.199755 0.778684 O\n0.818759 0.480255 0.313753 O\n0.181240 0.519743 0.686248 O\n0.768892 0.923981 0.514076 O\n0.773128 0.675559 0.939852 O\n0.231107 0.076016 0.485926 O\n0.215477 0.954089 0.866554 O\n0.274424 0.800243 0.221318 O\n0.784522 0.045908 0.133448 O\n",
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}