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{
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{
"id": "mp-1400737",
"created_at": "2022-09-04T14:42:00.662625Z",
"structure_string": "Mn2 P2 O8 F2\n1.0\n5.151054 0.000000 0.000000\n-0.600011 5.153329 0.000000\n-2.111389 -2.648594 6.385380\nMn P O F\n2 2 8 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.673881 0.350664 0.761634 P\n0.326119 0.649336 0.238366 P\n0.122785 0.680632 0.121030 O\n0.636644 0.767594 0.077574 O\n0.261014 0.790325 0.402722 O\n0.300397 0.334498 0.344259 O\n0.363356 0.232406 0.922426 O\n0.738986 0.209675 0.597278 O\n0.699603 0.665502 0.655741 O\n0.877215 0.319368 0.878970 O\n0.884111 0.054491 0.265009 F\n0.115889 0.945509 0.734991 F\n",
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{
"id": "mp-1033973",
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"structure_string": "K1 Na1 Mg14 O15\n1.0\n8.493266 0.000000 0.000000\n0.000000 8.841619 0.000000\n0.000000 0.000000 4.389545\nK Na Mg O\n1 1 14 15\ndirect\n0.071704 0.000000 -0.000000 K\n0.989666 0.500000 -0.000000 Na\n0.520906 0.000000 -0.000000 Mg\n0.500559 0.500000 -0.000000 Mg\n0.995570 0.257790 0.500000 Mg\n0.995570 0.742210 0.500000 Mg\n0.497113 0.246423 0.500000 Mg\n0.497113 0.753577 0.500000 Mg\n0.245976 0.000000 0.500000 Mg\n0.243140 0.500000 0.500000 Mg\n0.768646 0.000000 0.500000 Mg\n0.750290 0.500000 0.500000 Mg\n0.240218 0.282796 0.000000 Mg\n0.240218 0.717204 0.000000 Mg\n0.761231 0.247040 0.000000 Mg\n0.761231 0.752960 -0.000000 Mg\n0.266355 0.500000 -0.000000 O\n0.746736 0.000000 -0.000000 O\n0.728718 0.500000 -0.000000 O\n0.246433 0.239056 0.500000 O\n0.246433 0.760944 0.500000 O\n0.744508 0.247249 0.500000 O\n0.744508 0.752751 0.500000 O\n0.004412 0.000000 0.500000 O\n0.001607 0.500000 0.500000 O\n0.482372 0.000000 0.500000 O\n0.491995 0.500000 0.500000 O\n0.002806 0.257561 -0.000000 O\n0.002806 0.742439 -0.000000 O\n0.480580 0.232899 -0.000000 O\n0.480580 0.767101 -0.000000 O\n",
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"elements": [
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"formula_full": "K1 Na1 Mg14 O15",
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"spacegroup": 25
},
{
"id": "mp-867198",
"created_at": "2022-09-04T14:42:01.280167Z",
"structure_string": "Li1 Ga1 Pd2\n1.0\n0.000000 3.037106 3.037106\n3.037106 0.000000 3.037106\n3.037106 3.037106 0.000000\nLi Ga Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Ga\n0.750000 0.750000 0.750000 Pd\n0.250000 0.250000 0.250000 Pd\n",
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"volume": 56.02860957342878,
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"spacegroup": 225
},
{
"id": "mp-1221315",
"created_at": "2022-09-04T14:42:00.630055Z",
"structure_string": "Na8 Sr12 P16\n1.0\n7.375511 0.000000 0.000000\n0.000000 8.011307 0.000000\n0.000000 8.005172 15.296731\nNa Sr P\n8 12 16\ndirect\n0.863613 0.258903 0.250299 Na\n0.363613 0.741097 0.249701 Na\n0.136387 0.741097 0.749701 Na\n0.636387 0.258903 0.750299 Na\n0.684009 0.057235 0.125404 Na\n0.184009 0.942765 0.374596 Na\n0.315991 0.942765 0.874596 Na\n0.815991 0.057235 0.625404 Na\n0.536773 0.592252 0.102075 Sr\n0.036773 0.407748 0.397925 Sr\n0.462821 0.706704 0.602143 Sr\n0.962821 0.293296 0.897857 Sr\n0.463227 0.407748 0.897925 Sr\n0.963227 0.592252 0.602075 Sr\n0.537179 0.293296 0.397857 Sr\n0.037179 0.706704 0.102143 Sr\n0.315778 0.186398 0.627310 Sr\n0.815778 0.813602 0.872690 Sr\n0.684222 0.813602 0.372690 Sr\n0.184222 0.186398 0.127310 Sr\n0.864980 0.437311 0.035099 P\n0.364980 0.562689 0.464901 P\n0.133211 0.993827 0.534901 P\n0.633211 0.006173 0.965099 P\n0.135020 0.562689 0.964901 P\n0.635020 0.437311 0.535099 P\n0.866789 0.006173 0.465099 P\n0.366789 0.993827 0.034901 P\n0.979443 0.829109 0.249364 P\n0.479443 0.170891 0.250636 P\n0.020557 0.170891 0.750636 P\n0.520557 0.829109 0.749364 P\n0.756671 0.631437 0.250727 P\n0.256671 0.368563 0.249273 P\n0.243329 0.368563 0.749273 P\n0.743329 0.631437 0.750727 P\n",
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"formula_full": "Na8 Sr12 P16",
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"spacegroup": 14
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{
"id": "mp-1247323",
"created_at": "2022-09-04T14:42:00.639049Z",
"structure_string": "Re4 W4 N12\n1.0\n3.745064 -0.074544 -1.059370\n-1.489904 7.902101 0.332647\n-1.742588 -2.562086 8.938651\nRe W N\n4 4 12\ndirect\n0.408164 0.556457 0.698675 Re\n0.591836 0.443543 0.301325 Re\n0.990319 0.123876 0.124612 Re\n0.009681 0.876124 0.875388 Re\n0.675099 0.745729 0.538655 W\n0.324901 0.254271 0.461345 W\n0.157600 0.807595 0.169439 W\n0.842400 0.192405 0.830561 W\n0.147387 0.010497 0.329712 N\n0.852613 0.989503 0.670288 N\n0.748332 0.676574 0.951911 N\n0.251668 0.323426 0.048089 N\n0.426011 0.011758 0.120741 N\n0.573989 0.988242 0.879259 N\n0.107602 0.655642 0.490897 N\n0.892398 0.344358 0.509103 N\n0.023368 0.347567 0.272213 N\n0.976632 0.652433 0.727787 N\n0.472143 0.675839 0.279518 N\n0.527857 0.324161 0.720482 N\n",
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"elements": [
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"formula_full": "Re4 W4 N12",
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{
"id": "mp-1188582",
"created_at": "2022-09-04T14:42:00.723866Z",
"structure_string": "K4 Co2 P4 H12 O16\n1.0\n-0.000826 -5.366353 0.000464\n-5.795006 -2.684301 2.753099\n-5.924201 -2.683000 -12.181795\nK Co P H O\n4 2 4 12 16\ndirect\n0.165207 0.312034 0.357362 K\n0.165182 0.812026 0.857419 K\n0.834826 0.187979 0.142640 K\n0.834820 0.687924 0.642589 K\n0.499998 0.249999 0.750000 Co\n0.499999 0.750001 0.250000 Co\n0.145515 0.578713 0.130485 P\n0.145502 0.078725 0.630459 P\n0.854478 0.921281 0.369504 P\n0.854497 0.421280 0.869549 P\n0.262570 0.415465 0.059754 H\n0.262520 0.915405 0.559796 H\n0.737427 0.084533 0.440244 H\n0.737477 0.584595 0.940207 H\n0.677628 0.865923 0.077892 H\n0.677746 0.365889 0.577871 H\n0.378143 0.865792 0.077911 H\n0.378259 0.365758 0.577870 H\n0.322374 0.634074 0.422109 H\n0.322246 0.134116 0.922131 H\n0.621860 0.634207 0.422092 H\n0.621742 0.134250 0.922133 H\n0.073433 0.783218 0.069914 O\n0.073439 0.283322 0.569878 O\n0.926585 0.716784 0.430086 O\n0.926559 0.216676 0.930121 O\n0.482282 0.924865 0.110020 O\n0.482372 0.424890 0.609946 O\n0.517726 0.575122 0.389986 O\n0.517616 0.075142 0.890049 O\n0.370342 0.541909 0.192267 O\n0.370174 0.041817 0.692285 O\n0.895761 0.541925 0.192266 O\n0.895902 0.041914 0.692294 O\n0.629696 0.958099 0.307700 O\n0.629788 0.458174 0.807741 O\n0.104215 0.958080 0.307715 O\n0.104094 0.458096 0.807714 O\n",
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{
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"structure_string": "Zn1 Co1 F6\n1.0\n4.742676 -2.645516 0.000000\n4.742676 2.645516 0.000000\n3.266979 0.000000 4.338039\nZn Co F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Co\n0.672195 0.850818 0.237685 F\n0.850818 0.237685 0.672195 F\n0.762315 0.327805 0.149182 F\n0.149182 0.762315 0.327805 F\n0.327805 0.149182 0.762315 F\n0.237685 0.672195 0.850818 F\n",
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{
"id": "mp-1228613",
"created_at": "2022-09-04T14:42:00.778346Z",
"structure_string": "Ba1 H2 C2 O6\n1.0\n4.469878 0.000000 0.000000\n0.058696 4.502954 0.000000\n1.230671 0.223199 12.366723\nBa H C O\n1 2 2 6\ndirect\n0.936288 0.974311 0.995291 Ba\n0.182405 0.502198 0.175309 H\n0.502964 0.646321 0.828583 H\n0.314555 0.707529 0.395137 C\n0.700384 0.291652 0.605765 C\n0.422561 0.694210 0.307897 O\n0.720749 0.302079 0.696646 O\n0.388817 0.134134 0.115362 O\n0.115892 0.490769 0.880836 O\n0.051782 0.462501 0.118808 O\n0.453604 0.804296 0.880365 O\n",
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{
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"structure_string": "Li4 Ni6 Sn2 O16\n1.0\n-2.883467 5.165947 0.132020\n-2.874239 -1.470164 9.518907\n3.048775 5.265884 0.209364\nLi Ni Sn O\n4 6 2 16\ndirect\n0.335069 0.563381 0.355548 Li\n0.835174 0.063356 0.355522 Li\n0.165139 0.936515 0.643609 Li\n0.665269 0.436471 0.643485 Li\n0.249922 0.750018 0.000225 Ni\n0.749851 0.750160 0.000093 Ni\n0.000094 0.499860 0.000029 Ni\n0.749959 0.250028 0.000045 Ni\n0.249936 0.250151 0.000023 Ni\n0.500060 0.999872 0.000085 Ni\n0.749894 0.750132 0.500229 Sn\n0.250140 0.250088 0.500151 Sn\n0.110489 0.639567 0.808816 O\n0.610546 0.139592 0.808850 O\n0.388985 0.860366 0.191819 O\n0.889048 0.360424 0.191807 O\n0.901374 0.861978 0.226337 O\n0.401397 0.362055 0.226286 O\n0.130407 0.633019 0.227089 O\n0.630396 0.133076 0.227087 O\n0.668392 0.629257 0.221115 O\n0.168469 0.129288 0.221010 O\n0.832084 0.870666 0.778558 O\n0.332120 0.370731 0.778456 O\n0.369512 0.866893 0.773048 O\n0.869483 0.366939 0.773024 O\n0.598386 0.638013 0.773863 O\n0.098406 0.138102 0.773793 O\n",
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{
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},
{
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],
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"formula_full": "Pr4 Ga4 Pd4",
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{
"id": "mp-1245101",
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"structure_string": "V30 O75\n1.0\n12.138240 0.586079 0.066962\n0.561606 11.936562 0.114549\n0.082273 0.115685 12.561440\nV O\n30 75\ndirect\n0.130430 0.946491 0.175632 V\n0.961499 0.833487 0.764362 V\n0.866747 0.093370 0.728788 V\n0.887076 0.079900 0.178030 V\n0.932098 0.921381 0.985341 V\n0.254470 0.802055 0.752364 V\n0.103953 0.634170 0.939654 V\n0.526702 0.944575 0.396092 V\n0.795567 0.614597 0.739026 V\n0.903117 0.692612 0.131001 V\n0.712086 0.139831 0.487889 V\n0.186648 0.813662 0.526431 V\n0.333673 0.937961 0.977640 V\n0.546175 0.120288 0.954083 V\n0.984040 0.674517 0.403741 V\n0.083267 0.197680 0.315327 V\n0.934161 0.943828 0.511860 V\n0.359643 0.173225 0.338474 V\n0.529292 0.542294 0.682445 V\n0.687819 0.321097 0.837391 V\n0.315106 0.528942 0.866573 V\n0.417038 0.909856 0.636224 V\n0.498968 0.333132 0.513996 V\n0.628709 0.174041 0.169310 V\n0.621672 0.012247 0.712909 V\n0.171097 0.447613 0.372161 V\n0.680499 0.382137 0.299980 V\n0.725189 0.548105 0.992397 V\n0.444165 0.502349 0.290668 V\n0.381913 0.338501 0.073136 V\n0.117959 0.340355 0.290047 O\n0.243661 0.981050 0.085099 O\n0.789745 0.444807 0.318961 O\n0.032147 0.657577 0.075067 O\n0.906521 0.596845 0.470771 O\n0.475865 0.035606 0.675066 O\n0.409781 0.244916 0.454954 O\n0.086418 0.719142 0.495351 O\n0.719583 0.244760 0.394611 O\n0.060324 0.917728 0.033974 O\n0.992233 0.781002 0.896607 O\n0.543114 0.171838 0.272911 O\n0.319871 0.457254 0.358431 O\n0.398933 0.444717 0.161757 O\n0.632099 0.026722 0.848676 O\n0.641500 0.407687 0.735628 O\n0.410374 0.022519 0.339224 O\n0.656636 0.880388 0.687312 O\n0.589525 0.485479 0.233867 O\n0.856513 0.823364 0.064002 O\n0.277272 0.229452 0.014543 O\n0.966781 0.154664 0.675493 O\n0.138234 0.051354 0.269781 O\n0.088583 0.575639 0.339671 O\n0.228873 0.169971 0.386242 O\n0.407165 0.824648 0.014511 O\n0.257555 0.454824 0.782460 O\n0.877537 0.055926 0.034707 O\n0.890184 0.726200 0.711365 O\n0.215474 0.542162 0.987755 O\n0.727696 0.406141 0.948605 O\n0.256473 0.722500 0.630609 O\n0.421694 0.636481 0.289385 O\n0.149683 0.416276 0.495294 O\n0.901973 0.828889 0.447359 O\n0.549195 0.415801 0.407288 O\n0.483859 0.868407 0.512833 O\n0.640187 0.072359 0.061027 O\n0.702708 0.295496 0.177808 O\n0.659599 0.615898 0.690926 O\n0.773366 0.624867 0.881093 O\n0.860615 0.494218 0.713567 O\n0.506883 0.237611 0.069825 O\n0.965316 0.188911 0.211612 O\n0.599407 0.596688 0.015438 O\n0.587065 0.860405 0.310598 O\n0.965170 0.961833 0.218710 O\n0.223000 0.320308 0.055933 O\n0.899223 0.938954 0.651192 O\n0.225257 0.677742 0.846153 O\n0.481543 0.622498 0.585494 O\n0.607982 0.245753 0.561775 O\n0.076127 0.941921 0.505177 O\n0.270838 0.814829 0.427044 O\n0.163260 0.823866 0.228073 O\n0.423923 0.050248 0.950848 O\n0.908249 0.969032 0.842991 O\n0.914714 0.707874 0.265566 O\n0.846948 0.065390 0.466668 O\n0.343907 0.240745 0.220307 O\n0.423145 0.810296 0.735165 O\n0.754412 0.082526 0.230417 O\n0.441233 0.569173 0.796843 O\n0.011015 0.195951 0.422977 O\n0.574662 0.247011 0.872349 O\n0.793684 0.219304 0.810836 O\n0.259287 0.907572 0.859840 O\n0.622826 0.043371 0.446960 O\n0.274384 0.930528 0.624417 O\n0.459680 0.416829 0.620106 O\n0.726796 0.093624 0.643988 O\n0.815682 0.588866 0.101358 O\n0.032122 0.554181 0.872800 O\n0.392432 0.410416 0.953650 O\n0.092918 0.835567 0.718369 O\n",
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"elements": [
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"formula_full": "V30 O75",
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"total_magnetization": 1e-07,
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"updated_at": "2021-11-28T01:35:34.341000Z",
"spacegroup": 1
}
]
}