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{
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"structure_string": "Nd1 Ga3 B4 O12\n1.0\n5.901085 -0.004668 -1.474353\n-1.886959 5.591262 -1.474353\n-0.003354 -0.004668 6.082476\nNd Ga B O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Nd\n0.448497 -0.000000 0.551504 Ga\n0.000000 0.551503 0.448497 Ga\n0.551503 0.448496 0.000000 Ga\n0.054873 0.499999 0.945128 B\n0.500000 0.499999 0.500001 B\n0.499999 0.945127 0.054873 B\n0.945127 0.054872 0.500001 B\n0.355007 0.644992 0.500001 O\n0.500000 0.355007 0.644993 O\n0.644992 0.499999 0.355008 O\n0.027803 0.625063 0.785848 O\n0.374936 0.972197 0.214153 O\n0.500000 0.090245 0.909755 O\n0.909753 0.499999 0.090246 O\n0.090246 0.909754 0.500001 O\n0.972196 0.214152 0.374937 O\n0.625063 0.785847 0.027803 O\n0.214153 0.374936 0.972198 O\n0.785847 0.027802 0.625064 O\n",
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"structure_string": "K2 In1 Sb1 I6\n1.0\n7.550840 -0.000000 4.359479\n2.516947 7.119000 4.359479\n-0.000000 -0.000000 8.718959\nK In Sb I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Sb\n0.754583 0.245417 0.245417 I\n0.245417 0.245417 0.754583 I\n0.245417 0.754583 0.754583 I\n0.245417 0.754583 0.245417 I\n0.754583 0.245417 0.754583 I\n0.754583 0.754583 0.245417 I\n",
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{
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"structure_string": "Li6 Fe1 Si2 O8\n1.0\n5.080147 0.023852 0.001581\n0.412677 5.446395 -0.060727\n1.158475 0.057122 6.059381\nLi Fe Si O\n6 1 2 8\ndirect\n0.847141 0.600868 0.190649 Li\n0.383923 0.737232 0.967435 Li\n0.229292 0.631413 0.391611 Li\n0.770710 0.368586 0.608389 Li\n0.616079 0.262766 0.032564 Li\n0.152862 0.399130 0.809351 Li\n0.500001 -0.000000 0.500000 Fe\n0.119802 0.197085 0.275057 Si\n0.880200 0.802913 0.724942 Si\n0.706116 0.067914 0.776699 O\n0.211000 0.785647 0.706616 O\n0.293886 0.932084 0.223300 O\n0.814572 0.711933 0.484288 O\n0.765945 0.588286 0.901921 O\n0.234058 0.411712 0.098078 O\n0.185430 0.288066 0.515711 O\n0.789003 0.214352 0.293383 O\n",
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{
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"updated_at": "2022-09-04T14:38:09.141487Z",
"structure_string": "Li4 Ni3 O2 F6\n1.0\n5.099952 -0.004421 -0.004536\n-0.884988 -5.015197 0.004945\n-1.706288 0.270166 -5.596808\nLi Ni O F\n4 3 2 6\ndirect\n0.981899 0.261946 0.872488 Li\n0.018100 0.738053 0.127514 Li\n0.988041 0.239066 0.369444 Li\n0.011958 0.760933 0.630558 Li\n0.500000 -0.000000 0.000000 Ni\n0.501894 0.499189 0.239711 Ni\n0.498105 0.500811 0.760291 Ni\n0.725318 0.361026 0.055964 O\n0.274682 0.638973 0.944038 O\n0.231471 0.130506 0.174910 F\n0.779645 0.867525 0.310648 F\n0.760779 0.399583 0.566247 F\n0.239220 0.600417 0.433755 F\n0.768529 0.869494 0.825092 F\n0.220354 0.132475 0.689354 F\n",
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"structure_string": "Ca2 H8 S2 O12\n1.0\n5.640635 0.000000 0.110188\n-2.820318 7.659719 -0.055094\n2.673788 0.000000 5.747731\nCa H S O\n2 8 2 12\ndirect\n0.324520 0.149042 0.250000 Ca\n0.675478 0.850958 0.750001 Ca\n0.099787 0.655473 0.029609 H\n0.055687 0.655473 0.470392 H\n0.244640 0.493075 0.474298 H\n0.251566 0.506925 0.974298 H\n0.748432 0.493075 0.025703 H\n0.755358 0.506925 0.525703 H\n0.944312 0.344527 0.529609 H\n0.900212 0.344527 0.970392 H\n0.330973 0.161946 0.750000 S\n0.669026 0.838054 0.250001 S\n0.421320 0.049318 0.844075 O\n0.145732 0.367208 0.472235 O\n0.578678 0.950682 0.155926 O\n0.429757 0.730046 0.448737 O\n0.278524 0.632792 0.972235 O\n0.127998 0.049318 0.655925 O\n0.800286 0.730046 0.051264 O\n0.199713 0.269954 0.948737 O\n0.872000 0.950682 0.344076 O\n0.721475 0.367208 0.027766 O\n0.570241 0.269954 0.551263 O\n0.854267 0.632792 0.527766 O\n",
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{
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"created_at": "2022-09-04T14:38:04.833778Z",
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"structure_string": "Li2 V4 O2 F10\n1.0\n0.000000 4.667090 0.019733\n4.671661 0.000000 0.000000\n0.000000 -4.584676 -9.173147\nLi V O F\n2 4 2 10\ndirect\n0.000547 0.757264 0.000762 Li\n0.000547 0.242736 0.500762 Li\n0.355201 0.273832 0.834548 V\n0.671093 0.742407 0.679659 V\n0.355201 0.726168 0.334548 V\n0.671093 0.257593 0.179659 V\n0.602295 0.542804 0.812401 O\n0.602296 0.457196 0.312401 O\n0.363968 0.949266 0.168174 F\n0.039078 0.039404 0.331094 F\n0.306094 0.553192 0.502031 F\n0.694716 0.938545 0.504020 F\n0.306094 0.446808 0.002031 F\n0.967009 0.445748 0.667313 F\n0.039077 0.960596 0.831094 F\n0.967009 0.554252 0.167313 F\n0.363968 0.050734 0.668174 F\n0.694717 0.061455 0.004020 F\n",
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{
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"created_at": "2022-09-04T14:38:04.729615Z",
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"structure_string": "Li4 Fe2 B2 O8\n1.0\n3.469542 3.634607 -0.038444\n-3.469542 3.634607 0.038444\n-0.067435 0.000000 6.068910\nLi Fe B O\n4 2 2 8\ndirect\n0.323305 0.676696 0.716291 Li\n0.176545 0.176545 0.500000 Li\n0.823456 0.823455 0.500000 Li\n0.676696 0.323305 0.283709 Li\n0.195232 0.195232 -0.000000 Fe\n0.804769 0.804769 0.000000 Fe\n0.318141 0.681859 0.256486 B\n0.681860 0.318141 0.743514 B\n0.199108 0.800893 0.029713 O\n0.198697 0.801304 0.437681 O\n0.614977 0.717231 0.245950 O\n0.282770 0.385024 0.245950 O\n0.385025 0.282769 0.754050 O\n0.717232 0.614976 0.754050 O\n0.801305 0.198696 0.562319 O\n0.800894 0.199107 0.970287 O\n",
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{
"id": "jvasp-10199",
"created_at": "2022-09-04T14:38:08.422620Z",
"updated_at": "2022-09-04T14:38:08.422645Z",
"structure_string": "Sr1 Sn1 B2 O6\n1.0\n4.576821 -0.009634 4.342681\n1.859872 4.181897 4.342681\n-0.014863 -0.009634 6.309196\nSr Sn B O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 Sr\n0.499999 0.500001 0.500000 Sn\n0.764104 0.764107 0.764105 B\n0.235894 0.235895 0.235895 B\n0.716926 0.508594 0.057045 O\n0.057045 0.716928 0.508593 O\n0.491406 0.942956 0.283073 O\n0.283073 0.491409 0.942954 O\n0.942954 0.283075 0.491406 O\n0.508593 0.057047 0.716926 O\n",
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{
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"structure_string": "Li4 Ti4 Co4 O16\n1.0\n5.904892 0.000000 0.000000\n0.000000 5.904892 0.000000\n0.000000 0.000000 8.245129\nLi Ti Co O\n4 4 4 16\ndirect\n0.000000 0.227086 0.000000 Li\n0.000000 0.772914 0.500000 Li\n0.227086 0.000000 0.250000 Li\n0.772914 0.000000 0.750000 Li\n0.223329 0.500000 0.250000 Ti\n0.500000 0.223329 0.000000 Ti\n0.500000 0.776671 0.500000 Ti\n0.776671 0.500000 0.750000 Ti\n0.744119 0.744119 0.125000 Co\n0.744119 0.255880 0.375000 Co\n0.255880 0.744119 0.875000 Co\n0.255880 0.255880 0.625000 Co\n0.736538 0.989512 0.495077 O\n0.736538 0.010487 0.004923 O\n0.737053 0.486735 0.987908 O\n0.737053 0.513264 0.512093 O\n0.513264 0.737053 0.737908 O\n0.513264 0.262946 0.762093 O\n0.486735 0.737053 0.262093 O\n0.010487 0.736538 0.245077 O\n0.262946 0.513264 0.487908 O\n0.262946 0.486735 0.012093 O\n0.263462 0.989512 0.504923 O\n0.263462 0.010487 0.995078 O\n0.989512 0.263462 0.745078 O\n0.010487 0.263462 0.254923 O\n0.486735 0.262946 0.237907 O\n0.989512 0.736538 0.754923 O\n",
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{
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"structure_string": "Mo1 W3 Se6 S2\n1.0\n3.293319 0.000010 -0.000045\n-1.646650 2.852095 -0.000003\n-0.000341 -0.000600 34.531296\nMo W Se S\n1 3 6 2\ndirect\n0.666679 0.333360 0.281341 Mo\n0.333220 0.666502 0.096342 W\n0.333371 0.666715 0.466411 W\n0.666724 0.333416 0.658826 W\n0.333424 0.666803 0.707858 Se\n0.666573 0.333209 0.047307 Se\n0.666684 0.333356 0.417333 Se\n0.666548 0.333148 0.145427 Se\n0.666720 0.333401 0.515495 Se\n0.333364 0.666701 0.609732 Se\n0.333384 0.666748 0.325796 S\n0.333308 0.666632 0.236881 S\n",
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"structure_string": "Li4 Cr3 Fe1 O8\n1.0\n5.801716 -0.001383 -0.003790\n-2.899656 5.025069 -0.000023\n-2.897904 -1.672569 4.756129\nLi Cr Fe O\n4 3 1 8\ndirect\n0.500001 0.500000 0.500001 Li\n0.500001 0.000000 0.500000 Li\n0.000000 -0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Cr\n0.500001 0.000000 0.000000 Cr\n-0.000000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Fe\n0.514929 0.257460 0.772379 O\n0.985532 0.744762 0.226320 O\n0.518455 0.759223 0.773684 O\n0.014471 0.759220 0.773681 O\n0.985531 0.240781 0.226320 O\n0.481546 0.240778 0.226317 O\n0.014470 0.255239 0.773681 O\n0.485073 0.742541 0.227623 O\n",
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}