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{
"id": "jvasp-112864",
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{
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{
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"structure_string": "Li2 Re2 O6\n1.0\n4.513059 0.018654 2.979435\n1.612787 4.215088 2.979435\n0.026991 0.018654 5.407772\nLi Re O\n2 2 6\ndirect\n0.781275 0.781273 0.781275 Li\n0.281275 0.281274 0.281275 Li\n0.497554 0.497552 0.497554 Re\n0.997554 0.997552 0.997554 Re\n0.739624 0.124518 0.368030 O\n0.368030 0.739624 0.124520 O\n0.868030 0.624519 0.239625 O\n0.239624 0.868029 0.624520 O\n0.624520 0.239623 0.868030 O\n0.124520 0.368029 0.739624 O\n",
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{
"id": "jvasp-97662",
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"updated_at": "2022-09-04T14:35:55.311121Z",
"structure_string": "Na4 Li4 H16 C8 O20\n1.0\n6.788233 -0.058049 -0.982119\n-0.640548 7.603407 -2.838634\n0.299767 0.023287 10.252358\nNa Li H C O\n4 4 16 8 20\ndirect\n0.407599 0.139553 0.645664 Na\n0.592401 0.860448 0.354337 Na\n0.902794 0.147780 0.649178 Na\n0.097206 0.852220 0.350823 Na\n0.214417 0.427975 0.856189 Li\n0.785582 0.572026 0.143812 Li\n0.676971 0.872255 0.798725 Li\n0.323029 0.127746 0.201276 Li\n0.305860 0.793148 0.973219 H\n0.694139 0.206852 0.026782 H\n0.862298 0.036328 0.128793 H\n0.137702 0.963672 0.871208 H\n0.672658 0.418859 0.513868 H\n0.327341 0.581142 0.486133 H\n0.967009 0.614034 0.500152 H\n0.032990 0.385967 0.499848 H\n0.131636 0.534276 0.163176 H\n0.932573 0.569917 0.740503 H\n0.868363 0.465725 0.836825 H\n0.562987 0.442086 0.270685 H\n0.437013 0.557915 0.729316 H\n0.447997 0.526803 0.168889 H\n0.552003 0.473198 0.831111 H\n0.067427 0.430084 0.259497 H\n0.798450 0.897840 0.092811 C\n0.296370 0.756626 0.066863 C\n0.703630 0.243375 0.933138 C\n0.201550 0.102160 0.907190 C\n0.903598 0.733666 0.566180 C\n0.376808 0.716619 0.559843 C\n0.096402 0.266334 0.433821 C\n0.623192 0.283382 0.440157 C\n0.564703 0.546426 0.239693 O\n0.435296 0.453575 0.760308 O\n0.267167 0.593410 0.046055 O\n0.732833 0.406591 0.953945 O\n0.316187 0.878938 0.186124 O\n0.683812 0.121063 0.813876 O\n0.714856 0.827021 0.968779 O\n0.285144 0.172980 0.031222 O\n0.817791 0.823424 0.184373 O\n0.182209 0.176577 0.815628 O\n0.436666 0.735485 0.686446 O\n0.631038 0.161101 0.489570 O\n0.368962 0.838900 0.510431 O\n0.874442 0.741406 0.688054 O\n0.125558 0.258595 0.311947 O\n0.867655 0.849042 0.512219 O\n0.132345 0.150959 0.487781 O\n0.960435 0.466536 0.769115 O\n0.563333 0.264516 0.313555 O\n0.039565 0.533465 0.230886 O\n",
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{
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"created_at": "2022-09-04T14:38:43.883273Z",
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"structure_string": "Cu1 B1 O4\n1.0\n-2.555207 2.555208 2.348508\n2.555207 -2.555208 2.348508\n2.555208 2.555207 -2.348508\nCu B O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.500000 B\n0.618670 0.081061 0.812058 O\n0.193389 0.381330 0.462392 O\n0.269004 0.806611 0.187942 O\n-0.081062 0.730996 0.537607 O\n",
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{
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"created_at": "2022-09-04T14:38:30.602078Z",
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"structure_string": "Ho8 Ni2 B28\n1.0\n7.203376 -0.000000 -0.000000\n0.000000 7.203376 0.000000\n-0.000000 -0.000000 7.486567\nHo Ni B\n8 2 28\ndirect\n0.193318 0.331357 0.000000 Ho\n0.668643 0.193318 0.000000 Ho\n0.331357 0.806683 0.000000 Ho\n0.693318 0.168643 0.500000 Ho\n0.306683 0.831357 0.500000 Ho\n0.806683 0.668643 0.000000 Ho\n0.831357 0.693318 0.500000 Ho\n0.168643 0.306683 0.500000 Ho\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.539151 0.674896 0.733017 B\n0.089221 0.589222 0.250000 B\n0.410779 0.089221 0.250000 B\n0.589222 0.910779 0.250000 B\n0.910779 0.410779 0.250000 B\n0.000000 0.000000 0.388921 B\n0.589222 0.910779 0.750000 B\n0.410779 0.089221 0.750000 B\n0.089221 0.589222 0.750000 B\n0.460849 0.325105 0.733017 B\n0.500000 0.500000 0.111079 B\n0.910779 0.410779 0.750000 B\n0.174895 0.039151 0.766984 B\n0.825105 0.960850 0.766984 B\n0.325105 0.539151 0.733017 B\n0.960850 0.174895 0.766984 B\n0.039151 0.825105 0.766984 B\n0.000000 0.000000 0.611079 B\n0.460849 0.325105 0.266983 B\n0.539151 0.674896 0.266983 B\n0.825105 0.960850 0.233017 B\n0.325105 0.539151 0.266983 B\n0.674896 0.460849 0.266983 B\n0.039151 0.825105 0.233017 B\n0.960850 0.174895 0.233017 B\n0.174895 0.039151 0.233017 B\n0.674896 0.460849 0.733017 B\n0.500000 0.500000 0.888921 B\n",
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{
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"created_at": "2022-09-04T14:37:13.105137Z",
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"structure_string": "Li1 Be2 Os1\n1.0\n-9.267901 2.765509 -0.791388\n-6.226909 0.922950 1.416405\n-5.231056 3.763983 -0.317975\nLi Be Os\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.749976 0.000022 0.000027 Be\n0.250024 -0.000023 -0.000027 Be\n0.500000 -0.000001 0.000000 Os\n",
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{
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"structure_string": "Mg6 Fe4 N8\n1.0\n6.097328 0.002665 -0.031160\n-4.675093 5.926473 -0.000001\n0.004390 0.003463 5.090568\nMg Fe N\n6 4 8\ndirect\n0.229927 0.985878 0.048503 Mg\n0.770072 0.755950 0.451497 Mg\n0.770072 0.014121 0.951497 Mg\n0.229927 0.244048 0.548503 Mg\n-0.000000 0.604981 0.750000 Mg\n-0.000000 0.395018 0.250000 Mg\n0.594790 0.423554 0.106204 Fe\n0.405210 0.828764 0.393797 Fe\n0.594790 0.171234 0.606204 Fe\n0.405209 0.576444 0.893797 Fe\n0.312267 0.740744 0.052632 N\n0.212377 0.937982 0.516765 N\n0.787622 0.725604 0.983236 N\n0.787622 0.062016 0.483236 N\n0.212378 0.274394 0.016765 N\n0.687732 0.259254 0.947369 N\n0.312267 0.571522 0.552632 N\n0.687732 0.428476 0.447369 N\n",
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{
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{
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"updated_at": "2022-09-04T14:36:10.365530Z",
"structure_string": "Li2 Fe5 O5 F7\n1.0\n5.776555 0.028227 0.053096\n-0.936005 5.911708 0.027370\n-0.989841 -1.181900 5.668269\nLi Fe O F\n2 5 5 7\ndirect\n0.863377 0.674621 0.403599 Li\n0.318819 0.600829 0.123344 Li\n0.652755 0.396337 0.841045 Fe\n0.147017 0.352294 0.593149 Fe\n0.629330 0.153261 0.342587 Fe\n0.988569 0.008454 0.025999 Fe\n0.407473 0.887750 0.703770 Fe\n0.841393 0.416923 0.605536 O\n0.393525 0.589845 0.780371 O\n0.961678 0.115266 0.342325 O\n0.399824 0.182551 0.574427 O\n0.681792 0.071716 0.913239 O\n0.132699 0.278896 0.904254 F\n0.159707 0.537453 0.360558 F\n0.566894 0.414246 0.181383 F\n0.064459 0.862759 0.695015 F\n0.596737 0.829466 0.442580 F\n0.873945 0.681800 0.047806 F\n0.319994 0.945543 0.119023 F\n",
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}