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{
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"structure_string": "Li3 V6 O3 F15\n1.0\n2.537648 -4.395337 -0.000000\n2.537649 4.395336 0.000000\n0.000000 -0.000000 13.805085\nLi V O F\n3 6 3 15\ndirect\n0.670429 0.662783 0.129596 Li\n0.337218 0.007646 0.796263 Li\n0.992354 0.329572 0.462929 Li\n0.306750 0.970445 0.492335 V\n0.967733 0.307778 0.669765 V\n0.029555 0.336306 0.159002 V\n0.340047 0.032268 0.003099 V\n0.663695 0.693250 0.825669 V\n0.692223 0.659954 0.336432 V\n0.717406 0.001198 0.747589 O\n-0.001198 0.716208 0.414255 O\n0.283792 0.282595 0.080922 O\n0.019117 0.973224 0.907404 F\n0.022878 0.664524 0.078096 F\n0.981365 0.648406 0.747596 F\n0.667041 0.018636 0.080928 F\n0.718235 0.381938 0.238854 F\n0.663703 0.281765 0.572188 F\n0.362698 0.630214 0.243431 F\n0.618063 0.336298 0.905521 F\n0.351595 0.332959 0.414262 F\n0.335476 0.358353 0.744762 F\n0.641647 0.977123 0.411429 F\n0.267515 0.637303 0.576766 F\n0.369787 0.732485 0.910099 F\n0.954107 0.980883 0.240737 F\n0.026776 0.045894 0.574070 F\n",
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{
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"structure_string": "Ca1 La2 Sn1 O6\n1.0\n5.131999 -0.026128 2.837562\n1.661528 4.855659 2.837562\n-0.036753 -0.026128 5.864113\nCa La Sn O\n1 2 1 6\ndirect\n0.500001 0.500000 0.499999 Ca\n0.763751 0.763749 0.763748 La\n0.236251 0.236250 0.236250 La\n0.000000 0.000000 0.000000 Sn\n0.343909 0.784056 0.130113 O\n0.784056 0.130113 0.343908 O\n0.130114 0.343908 0.784055 O\n0.656093 0.215944 0.869886 O\n0.869887 0.656092 0.215943 O\n0.215945 0.869886 0.656091 O\n",
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{
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"created_at": "2022-09-04T14:38:03.414173Z",
"updated_at": "2022-09-04T14:38:03.414189Z",
"structure_string": "Mg4 H24 C8 O24\n1.0\n7.197630 -0.000000 0.000000\n0.000000 8.507897 0.000000\n0.000000 0.000000 8.731124\nMg H C O\n4 24 8 24\ndirect\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.347107 0.515465 0.620467 H\n0.642873 0.123730 0.994821 H\n0.847107 0.984536 0.620467 H\n0.417606 0.187823 0.170574 H\n0.152893 0.515465 0.120468 H\n0.357127 0.876270 0.005179 H\n0.857127 0.623730 0.005179 H\n0.642873 0.623730 0.505178 H\n0.582394 0.312178 0.670574 H\n0.082394 0.187823 0.670574 H\n0.652893 0.484535 0.379532 H\n0.142873 0.376270 0.994821 H\n0.347107 0.015465 0.879532 H\n0.857127 0.123730 0.494821 H\n0.652893 0.984536 0.120468 H\n0.357127 0.376270 0.494821 H\n0.917606 0.812178 0.329426 H\n0.417606 0.687823 0.329426 H\n0.082394 0.687823 0.829426 H\n0.582394 0.812178 0.829426 H\n0.142873 0.876270 0.505178 H\n0.152893 0.015465 0.379532 H\n0.917606 0.312178 0.170574 H\n0.847107 0.484535 0.879532 H\n0.520392 0.234807 0.759105 C\n0.979608 0.734807 0.240894 C\n0.979608 0.234807 0.259106 C\n0.020392 0.265194 0.759105 C\n0.479608 0.765194 0.240894 C\n0.479608 0.265194 0.259106 C\n0.520392 0.734807 0.740894 C\n0.020392 0.765194 0.740894 C\n0.478587 0.218368 0.397205 O\n0.978587 0.781633 0.102795 O\n0.218637 0.465040 0.032741 O\n0.454954 0.603151 0.782390 O\n0.718637 0.534960 0.467258 O\n0.521413 0.281633 0.897205 O\n0.954954 0.396850 0.717610 O\n0.954954 0.896850 0.782390 O\n0.021413 0.218368 0.897205 O\n0.521413 0.781633 0.602794 O\n0.545045 0.396850 0.217610 O\n0.021413 0.718368 0.602794 O\n0.045046 0.103150 0.217610 O\n0.454954 0.103150 0.717610 O\n0.218637 0.965040 0.467258 O\n0.281363 0.965040 0.967258 O\n0.545045 0.896850 0.282390 O\n0.978587 0.281633 0.397205 O\n0.718637 0.034960 0.032741 O\n0.781363 0.534960 0.967258 O\n0.045046 0.603151 0.282390 O\n0.478587 0.718368 0.102795 O\n0.281363 0.465040 0.532741 O\n0.781363 0.034960 0.532741 O\n",
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{
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"structure_string": "H14 S2 N4 O8\n1.0\n5.437647 -0.019383 1.517336\n1.885072 5.040786 1.622585\n0.042706 -0.038338 8.367961\nH S N O\n14 2 4 8\ndirect\n0.799069 0.802247 0.964950 H\n0.075751 0.219730 0.505210 H\n0.182518 0.870145 0.364340 H\n0.817483 0.129856 0.635661 H\n0.183270 0.760723 0.579749 H\n0.816731 0.239278 0.420252 H\n0.232494 0.400093 0.846271 H\n0.924249 0.780271 0.494790 H\n0.340205 0.068970 0.858136 H\n0.659796 0.931031 0.141865 H\n0.007976 0.249233 0.889863 H\n0.992024 0.750767 0.110137 H\n0.200931 0.197754 0.035051 H\n0.767507 0.599908 0.153730 H\n0.588038 0.631051 0.722154 S\n0.411963 0.368950 0.277847 S\n0.192158 0.226277 0.908204 N\n0.807843 0.773724 0.091797 N\n0.066280 0.867298 0.485033 N\n0.933720 0.132703 0.514967 N\n0.656086 0.813905 0.785019 O\n0.683248 0.660952 0.535481 O\n0.316752 0.339049 0.464520 O\n0.706679 0.352630 0.808582 O\n0.293322 0.647371 0.191418 O\n0.295422 0.703376 0.757786 O\n0.704578 0.296625 0.242214 O\n0.343914 0.186095 0.214981 O\n",
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{
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"created_at": "2022-09-04T14:38:03.428647Z",
"updated_at": "2022-09-04T14:38:03.428665Z",
"structure_string": "Ca1 H12 Br2 O6\n1.0\n4.049593 -7.014101 0.000000\n4.049593 7.014101 -0.000000\n-0.000000 0.000000 3.942197\nCa H Br O\n1 12 2 6\ndirect\n0.000000 0.000000 0.000000 Ca\n0.111000 0.774930 0.528899 H\n0.225069 0.336071 0.528899 H\n0.774930 0.111000 0.471102 H\n0.888999 0.663928 0.471102 H\n0.336071 0.225069 0.471102 H\n0.663928 0.888999 0.528899 H\n0.575254 0.672868 0.101131 H\n0.097613 0.424745 0.101131 H\n0.424745 0.097613 0.898870 H\n0.902386 0.327131 0.898870 H\n0.672868 0.575254 0.898870 H\n0.327131 0.902386 0.101131 H\n0.666667 0.333333 0.562871 Br\n0.333333 0.666667 0.437130 Br\n0.206456 0.206456 0.500000 O\n-0.000000 0.302999 0.000000 O\n0.697000 0.697000 0.000000 O\n0.302999 -0.000000 0.000000 O\n-0.000000 0.793543 0.500000 O\n0.793543 -0.000000 0.500000 O\n",
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{
"id": "jvasp-54869",
"created_at": "2022-09-04T14:37:49.915321Z",
"updated_at": "2022-09-04T14:37:49.915337Z",
"structure_string": "Ba1 Al1 Si1 H1\n1.0\n2.172964 -3.763684 -0.000000\n2.172964 3.763684 -0.000000\n0.000000 0.000000 5.245049\nBa Al Si H\n1 1 1 1\ndirect\n0.000000 0.000000 0.998696 Ba\n0.666666 0.333332 0.535476 Al\n0.333332 0.666666 0.454703 Si\n0.666666 0.333332 0.868225 H\n",
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{
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"structure_string": "Na6 Sr6 Ga2 P8\n1.0\n4.694754 -8.131552 -0.000000\n4.694754 8.131552 -0.000000\n-0.000000 -0.000000 7.379094\nNa Sr Ga P\n6 6 2 8\ndirect\n0.134021 0.865978 0.830949 Na\n0.865977 0.731957 0.330949 Na\n0.268042 0.134022 0.330949 Na\n0.731957 0.865977 0.830949 Na\n0.134022 0.268042 0.830949 Na\n0.865978 0.134021 0.330949 Na\n0.477423 0.522576 0.500114 Sr\n0.477423 0.954846 0.500114 Sr\n0.522576 0.477423 0.000114 Sr\n0.954846 0.477423 0.000114 Sr\n0.522577 0.045154 0.000114 Sr\n0.045154 0.522577 0.500114 Sr\n0.666667 0.333333 0.625154 Ga\n0.333333 0.666667 0.125154 Ga\n0.810304 0.620608 0.720080 P\n0.333333 0.666667 0.783414 P\n0.810304 0.189695 0.720080 P\n0.189695 0.379391 0.220080 P\n0.620608 0.810304 0.220080 P\n0.379391 0.189695 0.720080 P\n0.666667 0.333333 0.283414 P\n0.189695 0.810304 0.220080 P\n",
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{
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"structure_string": "K8 Na12 Tl4 O16\n1.0\n7.750484 0.000000 0.000000\n0.000000 9.265324 -0.000000\n0.000000 -0.000000 9.583554\nK Na Tl O\n8 12 4 16\ndirect\n0.246509 0.500000 0.000000 K\n0.253490 0.000000 0.500000 K\n0.753490 0.500000 0.000000 K\n0.746509 0.000000 0.500000 K\n0.500000 0.261924 0.749751 K\n0.500000 0.738076 0.250249 K\n0.000000 0.761923 0.750249 K\n0.000000 0.238076 0.249751 K\n0.748940 0.516163 0.652130 Na\n0.748940 0.483836 0.347869 Na\n0.751059 0.983836 0.152130 Na\n0.500000 0.258751 0.414555 Na\n0.500000 0.741248 0.585444 Na\n0.751059 0.016164 0.847869 Na\n0.000000 0.241249 0.914555 Na\n0.248940 0.983836 0.152130 Na\n0.248940 0.016164 0.847869 Na\n0.251060 0.483836 0.347869 Na\n0.251060 0.516163 0.652130 Na\n0.000000 0.758751 0.085444 Na\n0.500000 0.772986 0.880930 Tl\n0.500000 0.227014 0.119070 Tl\n0.000000 0.727014 0.380930 Tl\n0.000000 0.272986 0.619070 Tl\n0.747113 0.198400 0.014865 O\n0.500000 0.441872 0.221618 O\n0.752886 0.301600 0.514864 O\n0.000000 0.058128 0.721618 O\n0.752886 0.698400 0.485135 O\n0.747113 0.801599 0.985135 O\n0.247114 0.698400 0.485135 O\n0.000000 0.545302 0.221390 O\n0.252886 0.198400 0.014865 O\n0.252886 0.801599 0.985135 O\n0.000000 0.454698 0.778610 O\n0.500000 0.954698 0.721389 O\n0.500000 0.045302 0.278610 O\n0.500000 0.558128 0.778382 O\n0.247114 0.301600 0.514864 O\n0.000000 0.941872 0.278382 O\n",
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{
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"created_at": "2022-09-04T14:37:57.490873Z",
"updated_at": "2022-09-04T14:37:57.490897Z",
"structure_string": "Ba4 Pr2 Ru2 O12\n1.0\n0.000000 6.105699 0.020347\n6.044988 0.000000 0.000000\n0.000000 -6.123193 -8.577819\nBa Pr Ru O\n4 2 2 12\ndirect\n0.749262 0.499967 0.251644 Ba\n0.250738 -0.000033 0.248356 Ba\n0.250738 0.500033 0.748356 Ba\n0.749263 0.000033 0.751644 Ba\n0.500000 0.500000 0.500000 Pr\n0.500000 0.000000 -0.000000 Pr\n0.000000 0.500000 0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.180144 0.500028 0.227763 O\n0.819856 0.000028 0.272237 O\n0.251964 0.729904 0.025065 O\n0.748036 0.229904 0.474934 O\n0.748036 0.270096 0.974934 O\n0.748114 0.729988 0.974930 O\n0.251886 0.270012 0.025070 O\n0.748114 0.770012 0.474930 O\n0.180144 -0.000028 0.727763 O\n0.251886 0.229988 0.525070 O\n0.251965 0.770096 0.525065 O\n0.819856 0.499973 0.772237 O\n",
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{
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"structure_string": "Li6 Mn2 P4 O16\n1.0\n0.000000 4.759844 0.001694\n9.059485 0.000000 0.000000\n0.000000 -4.318854 -6.417132\nLi Mn P O\n6 2 4 16\ndirect\n0.336499 0.131255 0.332143 Li\n0.000000 0.500000 0.000000 Li\n0.663501 0.631256 0.167858 Li\n0.000000 0.000000 0.500000 Li\n0.336499 0.368745 0.832143 Li\n0.663502 0.868745 0.667858 Li\n0.500000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.167521 0.822015 0.192189 P\n0.832479 0.322015 0.307812 P\n0.167522 0.677986 0.692189 P\n0.832479 0.177985 0.807812 P\n0.465595 0.651232 0.662308 O\n0.827328 0.879642 0.992336 O\n0.534405 0.151232 0.837692 O\n0.172673 0.379642 0.507664 O\n0.754295 0.407360 0.116540 O\n0.874349 0.154792 0.291787 O\n0.125651 0.845209 0.708213 O\n0.754295 0.092640 0.616539 O\n0.827327 0.620359 0.492336 O\n0.465595 0.848769 0.162308 O\n0.172673 0.120359 0.007664 O\n0.534405 0.348768 0.337693 O\n0.245705 0.907360 0.383461 O\n0.874349 0.345209 0.791787 O\n0.245706 0.592640 0.883461 O\n0.125651 0.654792 0.208213 O\n",
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