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{
"id": "jvasp-9435",
"created_at": "2022-09-04T14:37:19.532642Z",
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"structure_string": "Al2 Tl2 F8\n1.0\n4.788524 -0.000000 -1.787495\n-0.657873 4.772948 -1.762377\n-0.000615 0.023644 7.306094\nAl Tl F\n2 2 8\ndirect\n0.500000 0.500000 -0.000000 Al\n0.000000 0.000000 0.000000 Al\n0.737922 0.250000 0.499999 Tl\n0.262077 0.750000 0.499999 Tl\n0.696014 0.644420 0.276593 F\n0.919420 0.855579 0.723405 F\n0.303985 0.355579 0.723405 F\n0.080578 0.144420 0.276593 F\n0.225367 0.725620 0.038556 F\n0.686811 0.774379 0.961442 F\n0.774631 0.274379 0.961442 F\n0.313188 0.225620 0.038556 F\n",
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{
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"structure_string": "U2 Cd4 O10\n1.0\n0.000000 -5.392595 0.000000\n2.061768 2.696297 5.500694\n-8.085124 0.000000 -0.065212\nU Cd O\n2 4 10\ndirect\n0.000000 0.000000 0.000000 U\n0.000001 0.000000 0.499999 U\n0.325138 0.694445 0.216943 Cd\n0.630693 0.305554 0.283056 Cd\n0.369308 0.694447 0.716943 Cd\n0.674862 0.305554 0.783057 Cd\n0.387478 0.185760 0.969559 O\n0.612522 0.814239 0.030439 O\n0.987148 0.328717 0.135859 O\n0.189172 0.000000 0.250000 O\n0.658432 0.671283 0.364141 O\n0.798284 0.185761 0.469561 O\n0.201718 0.814239 0.530440 O\n0.341569 0.328716 0.635858 O\n0.810825 0.999999 0.749998 O\n0.012851 0.671282 0.864140 O\n",
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{
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"structure_string": "Sr6 Al4 P8\n1.0\n6.667216 -0.014015 0.085882\n0.074598 8.085080 2.097549\n-0.022967 0.004432 8.353038\nSr Al P\n6 4 8\ndirect\n0.750001 0.598516 0.401485 Sr\n0.039959 0.748299 0.008663 Sr\n0.460041 0.991337 0.251701 Sr\n0.960041 0.251701 0.991337 Sr\n0.539959 0.008663 0.748299 Sr\n0.250000 0.401485 0.598515 Sr\n0.418458 0.418076 0.172261 Al\n0.918458 0.172262 0.418076 Al\n0.581543 0.581924 0.827739 Al\n0.081543 0.827738 0.581924 Al\n0.575590 0.259295 0.420765 P\n0.024160 0.058646 0.705814 P\n0.424411 0.740705 0.579235 P\n0.975840 0.941354 0.294186 P\n0.524161 0.705814 0.058646 P\n0.475840 0.294186 0.941354 P\n0.924411 0.579235 0.740705 P\n0.075590 0.420765 0.259295 P\n",
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{
"id": "jvasp-9973",
"created_at": "2022-09-04T14:37:19.574684Z",
"updated_at": "2022-09-04T14:37:19.574699Z",
"structure_string": "Li2 Ta2 Ge2 O10\n1.0\n5.263670 0.023819 -1.892107\n-1.057642 5.156373 -1.892107\n-0.011963 -0.014733 7.553262\nLi Ta Ge O\n2 2 2 10\ndirect\n0.693513 0.306487 0.250000 Li\n0.306488 0.693513 0.750000 Li\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.500000 Ta\n0.637049 0.362952 0.750000 Ge\n0.362952 0.637049 0.250000 Ge\n0.755998 0.233892 0.554670 O\n0.244003 0.766108 0.445330 O\n0.233892 0.755997 0.054670 O\n0.309414 0.293448 0.152896 O\n0.932728 0.067272 0.250000 O\n0.067273 0.932728 0.750000 O\n0.706552 0.690586 0.347104 O\n0.293449 0.309414 0.652896 O\n0.690587 0.706552 0.847104 O\n0.766109 0.244003 0.945330 O\n",
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{
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"updated_at": "2022-09-04T14:37:19.907147Z",
"structure_string": "Tb2 Cl4 F2\n1.0\n5.089161 0.014164 1.514418\n1.796966 4.761373 1.514418\n0.022143 0.015357 6.847898\nTb Cl F\n2 4 2\ndirect\n0.234863 0.765137 0.750001 Tb\n0.765137 0.234862 0.250000 Tb\n0.331322 0.287185 0.603406 Cl\n0.668678 0.712815 0.396595 Cl\n0.287185 0.331322 0.103405 Cl\n0.712815 0.668677 0.896595 Cl\n0.000000 0.000000 0.000000 F\n-0.000000 0.000000 0.500000 F\n",
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{
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"created_at": "2022-09-04T14:37:19.801849Z",
"updated_at": "2022-09-04T14:37:19.801874Z",
"structure_string": "V2 Si4 O12\n1.0\n5.344930 0.027815 0.021166\n1.613858 6.261592 0.015585\n1.620669 0.208348 6.256543\nV Si O\n2 4 12\ndirect\n0.246309 0.100412 0.398603 V\n0.746300 0.899314 0.599700 V\n0.243777 0.213450 0.884357 Si\n0.748831 0.786268 0.113947 Si\n0.248829 0.614663 0.285558 Si\n0.743775 0.385061 0.712753 Si\n0.949176 0.349296 0.867496 O\n0.043424 0.650413 0.130820 O\n0.362562 0.043141 0.683777 O\n0.272987 0.377001 0.400610 O\n0.862551 0.184492 0.542430 O\n0.130055 0.815238 0.455873 O\n0.449176 0.368202 0.848600 O\n0.630049 0.956583 0.314523 O\n0.219617 0.098407 0.122015 O\n0.543427 0.631519 0.149707 O\n0.773004 0.901306 0.876286 O\n0.719618 0.622725 0.597710 O\n",
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"formula_full": "V2 Si4 O12",
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{
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"created_at": "2022-09-04T14:37:19.897757Z",
"updated_at": "2022-09-04T14:37:19.897783Z",
"structure_string": "Ba2 C4 S4 N4\n1.0\n6.179946 0.027562 0.240697\n2.335749 5.721606 0.240697\n0.067762 0.045748 8.377307\nBa C S N\n2 4 4 4\ndirect\n0.900875 0.099125 0.750001 Ba\n0.099125 0.900875 0.250000 Ba\n0.753830 0.492835 0.100701 C\n0.492835 0.753830 0.600701 C\n0.246170 0.507166 0.899300 C\n0.507166 0.246170 0.399300 C\n0.345381 0.239439 0.838998 S\n0.760562 0.654619 0.661004 S\n0.654619 0.760562 0.161003 S\n0.239438 0.345382 0.338997 S\n0.827874 0.297250 0.057032 N\n0.297250 0.827874 0.557032 N\n0.702750 0.172127 0.442969 N\n0.172127 0.702751 0.942969 N\n",
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{
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"created_at": "2022-09-04T14:37:19.953458Z",
"updated_at": "2022-09-04T14:37:19.953485Z",
"structure_string": "Ti2 Zn2 F10\n1.0\n4.990130 0.071318 -1.861527\n-2.035947 4.868855 -0.721751\n-0.060115 -0.059518 7.521952\nTi Zn F\n2 2 10\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 -0.000000 0.500000 Ti\n0.275678 0.525677 0.750000 Zn\n0.724322 0.474322 0.250000 Zn\n0.375582 0.125581 0.250000 F\n0.624418 0.874417 0.749999 F\n0.559233 0.707683 0.361290 F\n0.846392 0.197942 0.138710 F\n0.766422 0.663824 0.041372 F\n0.122451 0.725049 0.458627 F\n0.233578 0.336174 0.958627 F\n0.877549 0.274950 0.541372 F\n0.153608 0.802057 0.861290 F\n0.440767 0.292316 0.638710 F\n",
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{
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"updated_at": "2022-09-04T14:37:20.147087Z",
"structure_string": "Ca2 Mn2 F10\n1.0\n5.554740 0.018454 -0.025791\n-1.818123 5.251585 0.022890\n-2.753071 -2.001370 7.036071\nCa Mn F\n2 2 10\ndirect\n0.797742 0.544484 0.249685 Ca\n0.205796 0.452578 0.750050 Ca\n0.001777 0.998533 -0.000129 Mn\n0.501772 0.998526 0.499866 Mn\n0.838905 0.088055 0.751088 F\n0.164637 0.908979 0.248664 F\n0.371125 0.203719 0.615891 F\n0.084063 0.749421 0.880010 F\n0.658198 0.715061 0.971230 F\n0.246247 0.687316 0.530126 F\n0.345339 0.282012 0.028504 F\n0.757288 0.309726 0.469609 F\n0.919503 0.247658 0.119735 F\n0.632429 0.793330 0.383857 F\n",
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{
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"structure_string": "Ca2 V2 F8\n1.0\n5.347506 0.000330 -0.000129\n-0.000249 5.393733 -0.029766\n-2.673448 -2.307423 5.387354\nCa V F\n2 2 8\ndirect\n0.254443 0.248905 0.500824 Ca\n0.745294 0.748902 0.500820 Ca\n0.499876 0.998913 0.000832 V\n0.999866 0.498912 0.000828 V\n0.834043 0.975884 0.285579 F\n0.612113 0.641686 0.793138 F\n0.165716 0.021886 0.716050 F\n0.679921 0.141683 0.793143 F\n0.387598 0.356139 0.208504 F\n0.950462 0.475897 0.285579 F\n0.319825 0.856138 0.208485 F\n0.049226 0.521863 0.716036 F\n",
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{
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"created_at": "2022-09-04T14:37:27.491114Z",
"updated_at": "2022-09-04T14:37:27.491140Z",
"structure_string": "Co2 Si4 O12\n1.0\n5.282856 0.029188 0.027630\n1.640624 6.078427 0.010410\n1.641156 0.242817 6.073447\nCo Si O\n2 4 12\ndirect\n0.753695 0.585855 0.915131 Co\n0.253694 0.415841 0.085144 Co\n0.755180 0.106713 0.789862 Si\n0.252227 0.894985 0.210410 Si\n0.752219 0.711126 0.394274 Si\n0.255170 0.290575 0.606003 Si\n0.049018 0.132572 0.645930 O\n0.958406 0.869097 0.354364 O\n0.639695 0.310830 0.971495 O\n0.718773 0.582839 0.633920 O\n0.139689 0.472207 0.810121 O\n0.867696 0.529494 0.190155 O\n0.549002 0.146635 0.631882 O\n0.367700 0.690865 0.028782 O\n0.788606 0.867069 0.918150 O\n0.458388 0.855072 0.368404 O\n0.218748 0.134637 0.082142 O\n0.288631 0.418842 0.366351 O\n",
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"updated_at": "2022-09-04T14:37:27.086898Z",
"structure_string": "Cr2 Si4 O12\n1.0\n6.188951 0.034386 -1.664126\n-0.247509 6.184095 1.664126\n0.004567 -0.004365 5.328100\nCr Si O\n2 4 12\ndirect\n0.094627 0.094628 0.750000 Cr\n0.905373 0.905375 0.249999 Cr\n0.786874 0.388943 0.247335 Si\n0.213126 0.611059 0.752665 Si\n0.611058 0.213127 0.747335 Si\n0.388942 0.786875 0.252665 Si\n0.814317 0.040388 0.865954 O\n0.630779 0.350588 0.452629 O\n0.350586 0.630779 0.047371 O\n0.372917 0.094508 0.721737 O\n0.627084 0.905494 0.278262 O\n0.369222 0.649415 0.547371 O\n0.094507 0.372917 0.778262 O\n0.185683 0.959615 0.134045 O\n0.040386 0.814318 0.634045 O\n0.959614 0.185684 0.365954 O\n0.905493 0.627085 0.221737 O\n0.649414 0.369223 0.952629 O\n",
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]
}