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{
"id": "jvasp-44693",
"created_at": "2022-09-04T14:38:09.348097Z",
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"structure_string": "Li1 Fe5 O8\n1.0\n5.721806 0.001932 0.002117\n2.860091 4.955757 0.012159\n2.857985 1.641453 4.676163\nLi Fe O\n1 5 8\ndirect\n0.000030 -0.000016 -0.000012 Li\n0.750006 0.749996 0.749968 Fe\n0.373605 0.373606 0.879181 Fe\n0.373618 0.373615 0.373613 Fe\n0.373609 0.879171 0.373608 Fe\n0.879154 0.373615 0.373614 Fe\n0.157500 0.614229 0.614145 O\n0.614222 0.157493 0.614153 O\n0.614138 0.614152 0.157480 O\n0.614119 0.614135 0.614232 O\n0.138006 0.138011 0.586078 O\n0.137998 0.138005 0.137914 O\n0.586091 0.137904 0.138010 O\n0.137903 0.586082 0.138016 O\n",
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{
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"structure_string": "Li4 Cr3 O8\n1.0\n5.714278 -0.004676 0.007660\n2.851705 4.943392 0.003705\n2.858422 1.643899 5.023419\nLi Cr O\n4 3 8\ndirect\n-0.004665 0.002426 0.000677 Li\n0.363179 0.354305 0.927223 Li\n0.504369 0.497313 0.500376 Li\n0.648142 0.638786 0.073682 Li\n0.487194 0.001437 0.510202 Cr\n-0.001107 -0.000363 0.496434 Cr\n-0.001384 0.507180 0.494852 Cr\n0.232492 0.236661 0.295058 O\n0.227088 0.740866 0.291258 O\n0.744728 0.745340 0.293469 O\n0.745112 0.215285 0.293955 O\n0.761040 0.766764 0.705762 O\n0.787933 0.253255 0.705711 O\n0.257157 0.256943 0.709273 O\n0.257701 0.775514 0.709450 O\n",
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{
"id": "jvasp-10064",
"created_at": "2022-09-04T14:37:30.324849Z",
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"structure_string": "Mn4 O8\n1.0\n5.229242 -0.607367 0.535316\n2.088626 4.832340 0.535316\n2.876374 1.660676 4.697098\nMn O\n4 8\ndirect\n0.125002 0.125004 0.874997 Mn\n0.124996 0.124997 0.375004 Mn\n0.625000 0.624999 0.125001 Mn\n0.624999 0.625000 0.625001 Mn\n0.320238 0.320239 0.429761 O\n0.429769 0.820242 0.374996 O\n0.320238 0.320239 0.929763 O\n0.820242 0.429769 0.374996 O\n0.429756 0.820230 0.875007 O\n0.820229 0.429757 0.875007 O\n0.929761 0.929760 0.320240 O\n0.929760 0.929760 0.820242 O\n",
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},
{
"id": "jvasp-15718",
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"updated_at": "2022-09-04T14:36:47.775715Z",
"structure_string": "Fe1 N1\n1.0\n2.589845 -0.000000 1.495248\n0.863282 2.441730 1.495248\n-0.000000 -0.000000 2.990495\nFe N\n1 1\ndirect\n0.000000 0.000000 0.000000 Fe\n0.250000 0.250000 0.250001 N\n",
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{
"id": "jvasp-104001",
"created_at": "2022-09-04T14:36:52.150381Z",
"updated_at": "2022-09-04T14:36:52.150399Z",
"structure_string": "Sn2 H8 C4 F4\n1.0\n4.736221 0.019561 0.942737\n1.888046 5.348108 2.217512\n0.256653 -0.040552 6.765463\nSn H C F\n2 8 4 4\ndirect\n0.601989 0.546911 0.517667 Sn\n0.835081 0.018134 0.018330 Sn\n0.043858 0.267236 0.158606 H\n0.393164 0.297876 0.377354 H\n0.729920 0.095575 0.496895 H\n0.707094 0.469500 0.039068 H\n0.486335 0.880887 0.721830 H\n0.222660 0.582527 0.991710 H\n0.950739 0.684184 0.814143 H\n0.214415 0.982545 0.544258 H\n0.630740 0.271804 0.375973 C\n0.806291 0.293283 0.159991 C\n0.326809 0.825622 0.674899 C\n0.110262 0.739451 0.861071 C\n0.482418 0.860694 0.180153 F\n0.954604 0.704387 0.355769 F\n0.959937 0.332110 0.704281 F\n0.477196 0.233000 0.831657 F\n",
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{
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"updated_at": "2022-09-04T14:38:54.625330Z",
"structure_string": "P1 H3\n1.0\n5.117027 0.506033 0.303322\n-2.215485 -3.542361 -0.269988\n-1.160690 -0.020483 -2.288870\nP H\n1 3\ndirect\n0.748076 0.454614 0.098438 P\n0.962991 0.884311 0.102085 H\n0.145907 0.465733 0.491325 H\n0.361365 0.465709 0.706724 H\n",
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"spacegroup": 44
},
{
"id": "jvasp-14726",
"created_at": "2022-09-04T14:36:47.938580Z",
"updated_at": "2022-09-04T14:36:47.938608Z",
"structure_string": "Nb1 B2\n1.0\n1.556339 -2.695659 0.000000\n1.556339 2.695659 -0.000000\n0.000000 -0.000000 3.380390\nNb B\n1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.333333 0.666667 0.500000 B\n0.666667 0.333333 0.500000 B\n",
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},
{
"id": "jvasp-104018",
"created_at": "2022-09-04T14:37:00.583152Z",
"updated_at": "2022-09-04T14:37:00.583174Z",
"structure_string": "H16 Pb2 C12 O8\n1.0\n4.516236 -0.096829 -0.274757\n-1.852455 7.674776 -0.435164\n-0.097144 -0.119935 10.433766\nH Pb C O\n16 2 12 8\ndirect\n0.705154 0.823242 0.693314 H\n0.079190 0.134920 0.299205 H\n0.092344 0.645724 0.289072 H\n0.096609 0.353149 0.345060 H\n0.095858 0.857514 0.347652 H\n0.636153 0.897357 0.455871 H\n0.620724 0.177749 0.402480 H\n0.618980 0.679110 0.400875 H\n0.631634 0.397110 0.451880 H\n0.178486 0.789851 0.581537 H\n0.165857 0.071844 0.530517 H\n0.161304 0.571605 0.526538 H\n0.700898 0.115790 0.637300 H\n0.701608 0.611443 0.634733 H\n0.718369 0.334028 0.683155 H\n0.176789 0.291205 0.579921 H\n0.941933 0.490445 0.989186 Pb\n0.855636 0.978549 0.993222 Pb\n0.240758 0.264346 0.318879 C\n0.362506 0.324818 0.193469 C\n0.392251 0.852104 0.201892 C\n0.476799 0.264840 0.430720 C\n0.477943 0.766713 0.431641 C\n0.248558 0.775372 0.319052 C\n0.405291 0.616870 0.780517 C\n0.319517 0.702248 0.550765 C\n0.556783 0.204605 0.663499 C\n0.548931 0.693593 0.663345 C\n0.435132 0.144149 0.788928 C\n0.320701 0.204111 0.551673 C\n0.228365 0.822542 0.091881 O\n0.131226 0.524181 0.768624 O\n0.182709 0.031928 0.789632 O\n0.569199 0.646487 0.890524 O\n0.615751 0.203771 0.893891 O\n0.666350 0.944742 0.213796 O\n0.614991 0.436997 0.192799 O\n0.181938 0.265247 0.088484 O\n",
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{
"id": "jvasp-101375",
"created_at": "2022-09-04T14:36:32.661028Z",
"updated_at": "2022-09-04T14:36:32.661056Z",
"structure_string": "Fe21 W2 C6\n1.0\n6.315217 -0.000091 3.646324\n2.104988 5.954088 3.646322\n0.000428 0.000301 7.291907\nFe W C\n21 2 6\ndirect\n0.616692 0.616691 0.149864 Fe\n0.383307 0.383309 0.850136 Fe\n0.999985 0.666247 0.333749 Fe\n0.666293 0.333707 -0.000001 Fe\n0.850172 0.383291 0.383266 Fe\n0.383291 0.850172 0.383267 Fe\n0.000013 0.000012 0.666208 Fe\n0.149827 0.616709 0.616734 Fe\n0.616710 0.616710 0.616772 Fe\n0.999991 0.666269 0.000033 Fe\n0.000005 0.000001 0.999998 Fe\n0.333708 0.666293 -0.000000 Fe\n0.383290 0.383290 0.383226 Fe\n0.616710 0.149828 0.616731 Fe\n0.999989 0.999986 0.333792 Fe\n0.333756 0.000016 0.666248 Fe\n0.666248 0.999985 0.333747 Fe\n0.000008 0.333734 -0.000032 Fe\n0.666267 -0.000007 0.000031 Fe\n0.000016 0.333753 0.666249 Fe\n0.333737 0.000008 0.999967 Fe\n0.249975 0.249974 0.250046 W\n0.750024 0.750025 0.749954 W\n0.724242 0.724242 0.275754 C\n0.275733 0.724262 0.275765 C\n0.275759 0.275758 0.724245 C\n0.275736 0.724268 0.724236 C\n0.724263 0.275733 0.275762 C\n0.724266 0.275738 0.724235 C\n",
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{
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"created_at": "2022-09-04T14:38:44.061766Z",
"updated_at": "2022-09-04T14:38:44.061790Z",
"structure_string": "Mo2 H16 N4 O8\n1.0\n6.520187 0.021370 2.910813\n3.193702 5.684502 2.910813\n0.059441 0.034915 7.701757\nMo H N O\n2 16 4 8\ndirect\n0.832639 0.832639 0.724482 Mo\n0.167361 0.167361 0.275517 Mo\n0.909607 0.909606 0.254478 H\n0.090393 0.090394 0.745521 H\n0.095309 0.346599 0.695125 H\n0.904691 0.653401 0.304874 H\n0.346599 0.095310 0.695125 H\n0.139619 0.139620 0.913118 H\n0.860381 0.860381 0.086881 H\n0.653401 0.904690 0.304874 H\n0.416004 0.670570 0.638074 H\n0.670569 0.416004 0.638074 H\n0.583996 0.329431 0.361926 H\n0.563797 0.563797 0.158249 H\n0.436203 0.436203 0.841750 H\n0.420144 0.420144 0.206428 H\n0.579855 0.579856 0.793572 H\n0.329430 0.583996 0.361926 H\n0.167278 0.167279 0.761863 N\n0.832722 0.832721 0.238137 N\n0.476356 0.476356 0.271244 N\n0.523643 0.523644 0.728756 N\n0.680539 0.680540 0.908279 O\n0.929494 0.929495 0.832962 O\n0.070505 0.070506 0.167038 O\n0.363258 0.922619 0.423444 O\n0.077381 0.636743 0.576556 O\n0.636742 0.077381 0.576556 O\n0.922619 0.363258 0.423444 O\n0.319461 0.319461 0.091720 O\n",
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{
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"structure_string": "Fe4 Ni8 B4 O20\n1.0\n3.012920 0.000000 0.000000\n0.000000 9.134004 -0.000000\n0.000000 -0.000000 12.366774\nFe Ni B O\n4 8 4 20\ndirect\n0.000000 0.238810 0.111145 Fe\n0.000000 0.761188 0.888853 Fe\n0.000000 0.738811 0.388853 Fe\n0.000000 0.261188 0.611146 Fe\n0.500001 -0.002101 0.280417 Ni\n0.500001 0.497900 0.219583 Ni\n0.500001 0.502100 0.780417 Ni\n0.500001 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500001 0.500000 0.500000 Ni\n0.500001 0.002101 0.719582 Ni\n0.000000 0.274098 0.359152 B\n0.000000 0.225903 0.859152 B\n0.000000 0.774097 0.140849 B\n0.000000 0.725902 0.640849 B\n0.000000 0.349184 0.261803 O\n0.000000 0.122621 0.359389 O\n0.500001 0.886828 0.422805 O\n0.500001 0.613172 0.922803 O\n0.500001 0.386828 0.077196 O\n0.000000 0.377379 0.859389 O\n0.000000 0.622621 0.140612 O\n0.000000 0.150815 0.761804 O\n0.000000 0.877379 0.640610 O\n0.500001 0.605034 0.354336 O\n0.500001 0.894967 0.854336 O\n0.500001 0.105034 0.145663 O\n0.000000 0.351078 0.456136 O\n0.500001 0.394966 0.645664 O\n0.500001 0.113172 0.577196 O\n0.000000 0.148921 0.956136 O\n0.000000 0.849184 0.238197 O\n0.000000 0.650814 0.738196 O\n0.000000 0.648921 0.543862 O\n0.000000 0.851079 0.043862 O\n",
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{
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"created_at": "2022-09-04T14:37:17.498961Z",
"updated_at": "2022-09-04T14:37:17.498983Z",
"structure_string": "Mg4 Co4 O8\n1.0\n-2.969280 0.001609 0.006078\n-0.004284 -7.430547 -0.042433\n0.015871 2.458105 6.868848\nMg Co O\n4 4 8\ndirect\n0.759087 0.797932 0.939887 Mg\n0.259024 0.176374 0.079283 Mg\n0.259097 0.928980 0.318106 Mg\n0.759021 0.045332 0.701067 Mg\n0.258871 0.419694 0.821462 Co\n0.258961 0.667013 0.548810 Co\n0.759151 0.307298 0.470362 Co\n0.759239 0.554615 0.197709 Co\n0.259135 0.416496 0.320790 O\n0.259047 0.166010 0.575908 O\n0.759065 0.808302 0.443264 O\n0.758967 0.557814 0.698382 O\n0.758956 0.294678 0.949646 O\n0.259038 0.926162 0.822928 O\n0.259151 0.679630 0.069526 O\n0.759071 0.048147 0.196245 O\n",
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}
]
}