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{
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{
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"structure_string": "Sr4 Tb4 O12\n1.0\n6.031965 -0.000000 0.000000\n-0.000000 6.212314 0.000000\n0.000000 0.000000 8.529501\nTb Sr O\n4 4 12\ndirect\n0.500000 0.000000 0.500000 Tb\n0.000000 0.500000 0.000000 Tb\n0.500000 0.000000 0.000000 Tb\n0.000000 0.500000 0.500000 Tb\n0.017596 0.948533 0.750000 Sr\n0.517596 0.551466 0.250000 Sr\n0.482405 0.448534 0.750000 Sr\n0.982405 0.051466 0.250000 Sr\n0.883177 0.551882 0.750000 O\n0.383177 0.948117 0.250000 O\n0.204514 0.207315 0.562635 O\n0.204514 0.207315 0.937365 O\n0.704514 0.292685 0.062635 O\n0.295486 0.707315 0.562635 O\n0.795487 0.792684 0.437365 O\n0.795487 0.792684 0.062635 O\n0.295486 0.707315 0.937365 O\n0.704514 0.292685 0.437365 O\n0.116824 0.448118 0.250000 O\n0.616824 0.051882 0.750000 O\n",
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{
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"created_at": "2022-09-04T14:36:46.811328Z",
"updated_at": "2022-09-04T14:36:46.811340Z",
"structure_string": "Sn8 O4 F8\n1.0\n7.931978 0.000000 0.000000\n0.000000 7.931978 -0.000000\n0.000000 0.000000 5.604333\nSn O F\n8 4 8\ndirect\n0.227802 0.500000 0.185874 Sn\n0.000000 0.727802 0.685874 Sn\n0.000000 0.272198 0.685874 Sn\n0.772199 0.500000 0.185874 Sn\n0.727802 0.000000 0.314125 Sn\n0.500000 0.227802 0.814125 Sn\n0.500000 0.772199 0.814125 Sn\n0.272198 0.000000 0.314125 Sn\n0.500000 0.000000 0.107321 O\n0.500000 0.000000 0.607320 O\n0.000000 0.500000 0.892679 O\n0.000000 0.500000 0.392679 O\n0.199953 0.199953 0.000000 F\n0.199953 0.800047 0.000000 F\n0.800047 0.199953 0.000000 F\n0.800047 0.800047 0.000000 F\n0.699953 0.699953 0.500000 F\n0.699953 0.300047 0.500000 F\n0.300047 0.699953 0.500000 F\n0.300047 0.300047 0.500000 F\n",
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{
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"created_at": "2022-09-04T14:36:52.252981Z",
"updated_at": "2022-09-04T14:36:52.253009Z",
"structure_string": "Na4 Ta4 O12\n1.0\n5.526206 -0.025920 -0.000000\n-0.036351 5.526148 0.000000\n-0.000000 0.000000 7.869904\nNa Ta O\n4 4 12\ndirect\n0.503309 0.496692 0.250000 Na\n0.496692 0.503309 0.750000 Na\n0.011631 0.988370 0.250000 Na\n0.988370 0.011631 0.750000 Na\n0.000000 0.500000 0.500000 Ta\n0.500000 -0.000000 0.500000 Ta\n0.500000 -0.000000 0.000000 Ta\n0.000000 0.500000 0.000000 Ta\n0.294895 0.294895 0.500000 O\n0.705106 0.705106 0.000000 O\n0.964921 0.451136 0.750000 O\n0.207186 0.792814 0.959119 O\n0.792815 0.207186 0.459120 O\n0.792815 0.207186 0.040880 O\n0.207186 0.792814 0.540880 O\n0.548865 0.035080 0.750000 O\n0.451136 0.964920 0.250000 O\n0.035080 0.548865 0.250000 O\n0.294895 0.294895 0.000000 O\n0.705106 0.705106 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:36:58.846737Z",
"updated_at": "2022-09-04T14:36:58.846766Z",
"structure_string": "Mg2 H4 C6 O8\n1.0\n4.349340 -0.122238 -1.311284\n-0.408976 5.762268 0.142442\n-0.216346 0.294734 7.655934\nMg H C O\n2 4 6 8\ndirect\n0.932487 0.160898 0.566865 Mg\n0.030616 0.229395 0.008079 Mg\n0.345899 0.603342 0.544064 H\n0.361719 0.786564 0.294557 H\n0.747528 0.663731 0.681504 H\n0.313726 0.704231 0.068283 H\n0.480459 0.716746 0.206957 C\n0.505451 0.653561 0.679880 C\n0.757864 0.886046 0.208413 C\n0.567209 0.475120 0.287254 C\n0.451976 0.473118 0.820152 C\n0.413827 0.894017 0.701004 C\n0.171655 0.377882 0.797249 O\n0.677564 0.420564 0.956699 O\n0.826231 0.454430 0.411029 O\n0.173559 0.909804 0.748026 O\n0.815769 0.931186 0.056310 O\n0.561182 0.074211 0.650885 O\n0.921388 0.974074 0.358643 O\n0.365022 0.303934 0.233101 O\n",
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{
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"created_at": "2022-09-04T14:36:51.489999Z",
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"structure_string": "Sr4 P4 S12\n1.0\n0.000000 6.684582 0.008852\n7.579378 0.000000 0.000000\n0.000000 -6.387342 -9.434799\nSr P S\n4 4 12\ndirect\n0.708493 0.611762 0.749674 Sr\n0.291507 0.111761 0.750326 Sr\n0.291507 0.388239 0.250326 Sr\n0.708493 0.888239 0.249674 Sr\n0.370744 0.608818 0.933869 P\n0.629257 0.108818 0.566131 P\n0.629256 0.391182 0.066131 P\n0.370744 0.891182 0.433869 P\n0.782594 0.308222 0.963081 S\n0.217406 0.808222 0.536920 S\n0.137746 0.504111 0.738427 S\n0.862254 0.004111 0.761573 S\n0.862254 0.495889 0.261573 S\n0.405512 0.199643 0.057034 S\n0.594488 0.800357 0.942967 S\n0.405512 0.300357 0.557034 S\n0.782594 0.191778 0.463081 S\n0.594488 0.699643 0.442967 S\n0.137746 0.995889 0.238427 S\n0.217406 0.691778 0.036919 S\n",
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{
"id": "jvasp-52906",
"created_at": "2022-09-04T14:36:54.896452Z",
"updated_at": "2022-09-04T14:36:54.896476Z",
"structure_string": "Zn4 H8 O8\n1.0\n4.897610 0.000000 0.000000\n0.000000 5.243935 0.000000\n0.000000 0.000000 8.165770\nZn H O\n4 8 8\ndirect\n0.936268 0.152507 0.873135 Zn\n0.563732 0.847493 0.373135 Zn\n0.436268 0.347493 0.126865 Zn\n0.063732 0.652508 0.626865 Zn\n0.195114 0.929796 0.111476 H\n0.304886 0.070205 0.611476 H\n0.804886 0.429796 0.388524 H\n0.695114 0.570205 0.888524 H\n0.134458 0.639382 0.286031 H\n0.865542 0.139381 0.213969 H\n0.634458 0.860620 0.713969 H\n0.365542 0.360619 0.786031 H\n0.305829 0.668772 0.220594 O\n0.867541 0.606293 0.417262 O\n0.632459 0.393708 0.917262 O\n0.367541 0.893709 0.582738 O\n0.132459 0.106292 0.082738 O\n0.805829 0.831229 0.779406 O\n0.694171 0.168772 0.279406 O\n0.194171 0.331228 0.720594 O\n",
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{
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"structure_string": "Sb2 N18\n1.0\n6.357418 0.042358 4.397266\n2.327594 5.916152 4.397266\n0.061741 0.042359 7.729741\nSb N\n2 18\ndirect\n0.693181 0.693181 0.693182 Sb\n0.306818 0.306819 0.306819 Sb\n0.165955 0.855354 0.346288 N\n0.144645 0.653712 0.834045 N\n0.653712 0.834045 0.144647 N\n0.834045 0.144646 0.653713 N\n0.742671 0.242661 0.263457 N\n0.242661 0.263457 0.742671 N\n0.263457 0.742671 0.242662 N\n0.257329 0.757339 0.736544 N\n0.757338 0.736543 0.257330 N\n0.736543 0.257329 0.757339 N\n0.624084 0.130815 0.367656 N\n0.130815 0.367656 0.624084 N\n0.367656 0.624084 0.130816 N\n0.375915 0.869185 0.632345 N\n0.869185 0.632344 0.375917 N\n0.632344 0.375916 0.869185 N\n0.346287 0.165955 0.855354 N\n0.855354 0.346288 0.165956 N\n",
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{
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"updated_at": "2022-09-04T14:36:46.297397Z",
"structure_string": "Li4 Mn4 F12\n1.0\n5.230421 0.000000 0.000000\n0.000000 5.220419 0.000000\n0.000000 0.000000 8.359539\nLi Mn F\n4 4 12\ndirect\n0.483413 0.863413 0.002073 Li\n0.983413 0.363413 0.497927 Li\n0.483413 0.636587 0.502073 Li\n0.983413 0.136587 0.997927 Li\n0.450321 0.353505 0.175492 Mn\n0.950321 0.853505 0.324508 Mn\n0.450321 0.146495 0.675493 Mn\n0.950321 0.646495 0.824508 Mn\n0.728211 0.994148 0.837667 F\n0.228211 0.494148 0.662334 F\n0.724394 0.454841 0.651092 F\n0.646933 0.953457 0.493350 F\n0.146933 0.046543 0.506650 F\n0.724394 0.045159 0.151092 F\n0.728211 0.505852 0.337667 F\n0.228211 0.005852 0.162334 F\n0.224394 0.954841 0.848908 F\n0.646933 0.546543 -0.006650 F\n0.224394 0.545159 0.348908 F\n0.146933 0.453457 0.006650 F\n",
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"formula_full": "Li4 Mn4 F12",
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{
"id": "jvasp-12089",
"created_at": "2022-09-04T14:36:58.885069Z",
"updated_at": "2022-09-04T14:36:58.885092Z",
"structure_string": "Hg4 Br4 O12\n1.0\n4.429891 -0.000000 -1.052941\n-0.605617 8.149164 -2.547927\n-0.035961 -0.081776 9.693804\nHg Br O\n4 4 12\ndirect\n0.900604 0.017889 0.870799 Hg\n0.099395 0.982109 0.129200 Hg\n0.970194 0.517889 0.870799 Hg\n0.029806 0.482110 0.129201 Hg\n0.278326 0.662837 0.647113 Br\n0.631212 0.837161 0.352886 Br\n0.721673 0.337161 0.352886 Br\n0.368787 0.162838 0.647113 Br\n0.686936 0.047371 0.653135 O\n0.033800 0.452628 0.346864 O\n0.340309 0.215609 0.824883 O\n0.122695 0.834186 0.628822 O\n0.493873 0.665813 0.371177 O\n0.877304 0.165813 0.371177 O\n0.506126 0.334186 0.628822 O\n0.484574 0.715609 0.824883 O\n0.659691 0.784390 0.175116 O\n0.515425 0.284390 0.175116 O\n0.966199 0.547371 0.653135 O\n0.313063 0.952628 0.346864 O\n",
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},
{
"id": "jvasp-122007",
"created_at": "2022-09-04T14:38:54.509757Z",
"updated_at": "2022-09-04T14:38:54.509784Z",
"structure_string": "Li6 Mn2 Co2 O10\n1.0\n4.886562 -0.002388 1.026375\n4.066407 2.709766 1.026375\n-0.029924 -0.009049 12.494933\nLi Mn Co O\n6 2 2 10\ndirect\n0.701530 0.701530 0.103196 Li\n0.102828 0.102828 0.318996 Li\n0.497483 0.497483 0.494913 Li\n0.902688 0.902688 0.691118 Li\n0.300233 0.300232 0.892438 Li\n0.793699 0.793700 0.407675 Li\n0.000187 0.000187 -0.003604 Mn\n0.402642 0.402642 0.207851 Mn\n0.599911 0.599911 0.798712 Co\n0.198238 0.198238 0.596752 Co\n0.562805 0.562804 0.656176 O\n0.040634 0.040633 0.141803 O\n0.454970 0.454970 0.334574 O\n0.830167 0.830167 0.557426 O\n0.231327 0.231326 0.749409 O\n0.638953 0.638952 0.948306 O\n0.364113 0.364114 0.046873 O\n0.769979 0.769979 0.242336 O\n0.146501 0.146500 0.463152 O\n0.961120 0.961120 0.851886 O\n",
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]
}