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{
"id": "mp-1186105",
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{
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{
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{
"id": "mp-759789",
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"structure_string": "Li10 V6 P16 O58\n1.0\n4.899291 8.489587 0.000000\n-4.899291 8.489587 0.000000\n0.000000 0.018162 13.926648\nLi V P O\n10 6 16 58\ndirect\n0.907017 0.321834 0.939037 Li\n0.905078 0.772056 0.439774 Li\n0.772056 0.905078 0.939774 Li\n0.679963 0.094726 0.558283 Li\n0.674504 0.230048 0.060923 Li\n0.321834 0.907017 0.439037 Li\n0.228195 0.090297 0.059282 Li\n0.090297 0.228195 0.559282 Li\n0.230048 0.674504 0.560923 Li\n0.094726 0.679963 0.058283 Li\n0.001037 0.565913 0.250763 V\n0.570107 0.433167 0.253971 V\n0.565913 0.001037 0.750763 V\n0.430469 0.000346 0.248224 V\n0.433167 0.570107 0.753971 V\n0.000346 0.430469 0.748224 V\n0.911550 0.319523 0.158803 P\n0.766624 0.317975 0.656504 P\n0.911979 0.769602 0.657192 P\n0.665600 0.668423 0.373287 P\n0.668423 0.665600 0.873287 P\n0.769602 0.911979 0.157192 P\n0.678959 0.087978 0.341166 P\n0.317975 0.766624 0.156504 P\n0.683583 0.229647 0.842975 P\n0.319523 0.911550 0.658803 P\n0.230629 0.087331 0.843075 P\n0.334277 0.334848 0.127170 P\n0.334848 0.334277 0.627170 P\n0.087331 0.230629 0.343075 P\n0.229647 0.683583 0.342975 P\n0.087978 0.678959 0.841166 P\n0.005724 0.238810 0.434304 O\n0.913846 0.337641 0.657694 O\n0.792204 0.211412 0.752844 O\n0.756441 0.246222 0.933827 O\n0.898700 0.479981 0.175550 O\n0.745551 0.335206 0.160732 O\n0.812689 0.512968 0.832909 O\n0.901980 0.618660 0.676288 O\n0.002034 0.758529 0.930760 O\n0.917635 0.745814 0.159315 O\n0.667602 0.517243 0.325893 O\n0.813590 0.672404 0.333217 O\n0.615968 0.478515 0.677866 O\n0.665006 0.663864 0.479815 O\n0.663864 0.665006 0.979815 O\n0.478515 0.615968 0.177866 O\n0.672404 0.813590 0.833217 O\n0.517243 0.667602 0.825893 O\n0.745814 0.917635 0.659315 O\n0.790569 0.998648 0.249982 O\n0.757980 0.000817 0.068075 O\n0.758529 0.002034 0.430760 O\n0.618660 0.901980 0.176288 O\n0.512968 0.812689 0.332909 O\n0.335206 0.745551 0.660732 O\n0.665797 0.082575 0.843272 O\n0.479981 0.898700 0.675550 O\n0.755580 0.235521 0.570941 O\n0.246222 0.756441 0.433827 O\n0.520174 0.097803 0.324372 O\n0.337641 0.913846 0.157694 O\n0.211412 0.792204 0.252844 O\n0.659632 0.254917 0.335622 O\n0.487184 0.184495 0.669799 O\n0.377352 0.101950 0.823487 O\n0.238810 0.005724 0.934304 O\n0.239373 0.998282 0.568259 O\n0.208650 0.999431 0.750422 O\n0.254766 0.081463 0.338830 O\n0.488360 0.328758 0.169747 O\n0.521454 0.381159 0.823824 O\n0.326235 0.187562 0.167338 O\n0.336868 0.332698 0.520827 O\n0.332698 0.336868 0.020827 O\n0.381159 0.521454 0.323824 O\n0.187562 0.326235 0.667338 O\n0.328758 0.488360 0.669747 O\n0.081463 0.254766 0.838830 O\n0.999431 0.208650 0.250422 O\n0.998282 0.239373 0.068259 O\n0.101950 0.377352 0.323487 O\n0.184495 0.487184 0.169799 O\n0.254917 0.659632 0.835622 O\n0.097803 0.520174 0.824372 O\n0.235521 0.755580 0.070941 O\n0.082575 0.665797 0.343272 O\n0.000817 0.757980 0.568075 O\n0.998648 0.790569 0.749982 O\n",
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"formula_full": "Li10 V6 P16 O58",
"formula_reduced": "Li5V3P8O29",
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{
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"created_at": "2022-09-04T14:40:24.771456Z",
"structure_string": "Li2 Nb1 F6\n1.0\n2.514714 -4.355612 0.000000\n2.514714 4.355612 0.000000\n0.000000 0.000000 4.709586\nLi Nb F\n2 1 6\ndirect\n0.333333 0.666667 0.500000 Li\n0.666667 0.333333 0.500000 Li\n0.000000 0.000000 0.000000 Nb\n0.323330 0.000000 0.255650 F\n0.000000 0.323330 0.255650 F\n0.000000 0.676670 0.744350 F\n0.676670 0.676670 0.255650 F\n0.676670 0.000000 0.744350 F\n0.323330 0.323330 0.744350 F\n",
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"formula_full": "Li2 Nb1 F6",
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{
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"structure_string": "Na2 Sr1 Ca1\n1.0\n-7.244435 7.387244 10.266966\n7.244435 -7.387244 10.266966\n7.244435 7.387244 -10.266966\nNa Sr Ca\n2 1 1\ndirect\n0.754228 0.000000 0.754228 Na\n0.245772 0.000000 0.245772 Na\n0.500000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Ca\n",
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{
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"structure_string": "Li2 Mn2 H8 S4 O20\n1.0\n12.844860 0.000000 0.000000\n0.000000 5.334009 0.000000\n0.000000 1.006735 5.450525\nLi Mn H S O\n2 2 8 4 20\ndirect\n0.616374 0.010490 0.417466 Li\n0.116374 0.989510 0.582534 Li\n0.497634 0.745056 0.005147 Mn\n0.997634 0.254944 0.994853 Mn\n0.703862 0.759993 0.096982 H\n0.798682 0.258271 0.087786 H\n0.650683 0.570239 0.317957 H\n0.853320 0.073366 0.313136 H\n0.150683 0.429761 0.682043 H\n0.353320 0.926634 0.686864 H\n0.203862 0.240007 0.903018 H\n0.298682 0.741729 0.912214 H\n0.115933 0.683087 0.226122 S\n0.381021 0.181449 0.228488 S\n0.615933 0.316913 0.773878 S\n0.881021 0.818551 0.771512 S\n0.673318 0.264762 0.007243 O\n0.822377 0.774022 0.001032 O\n0.458369 0.387895 0.235184 O\n0.637713 0.733684 0.197986 O\n0.059440 0.428149 0.246531 O\n0.040790 0.894290 0.239413 O\n0.865104 0.227696 0.181419 O\n0.448706 0.935649 0.248043 O\n0.181990 0.659675 0.447204 O\n0.681990 0.340325 0.552796 O\n0.314494 0.137989 0.446448 O\n0.814494 0.862011 0.553552 O\n0.559440 0.571851 0.753469 O\n0.137713 0.266316 0.802014 O\n0.958369 0.612105 0.764816 O\n0.948706 0.064351 0.751957 O\n0.365104 0.772304 0.818581 O\n0.540790 0.105710 0.760587 O\n0.173318 0.735238 0.992757 O\n0.322377 0.225978 0.998968 O\n",
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{
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"structure_string": "Mg1 As4 P4 O16\n1.0\n5.070077 0.000000 0.000000\n0.000000 8.677735 0.644960\n0.000000 0.653288 8.637254\nMg As P O\n1 4 4 16\ndirect\n0.750000 0.498830 0.780621 Mg\n0.250000 0.694778 0.698535 As\n0.750000 0.322051 0.322712 As\n0.750000 0.204868 0.825389 As\n0.250000 0.842639 0.197856 As\n0.250000 0.337329 0.608251 P\n0.750000 0.663601 0.378831 P\n0.750000 0.803870 0.857124 P\n0.250000 0.196855 0.138750 P\n0.250000 0.401262 0.436940 O\n0.750000 0.593222 0.549844 O\n0.750000 0.847196 0.017720 O\n0.250000 0.167280 0.973354 O\n0.250000 0.478031 0.716663 O\n0.750000 0.539289 0.263919 O\n0.750000 0.907590 0.704557 O\n0.250000 0.037622 0.260816 O\n0.999802 0.292182 0.172996 O\n0.509802 0.671328 0.852275 O\n0.997385 0.770867 0.346574 O\n0.497921 0.239133 0.655071 O\n0.990198 0.671328 0.852275 O\n0.500198 0.292182 0.172996 O\n0.002079 0.239133 0.655071 O\n0.502615 0.770867 0.346574 O\n",
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{
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"structure_string": "Yb12 Dy4 Sb12\n1.0\n9.385028 0.000000 0.000000\n0.000000 9.385028 0.000000\n0.000000 0.000000 9.385028\nYb Dy Sb\n12 4 12\ndirect\n0.823230 0.323230 0.176770 Yb\n0.930148 0.930148 0.930148 Yb\n0.825458 0.674542 0.325458 Yb\n0.176770 0.823230 0.323230 Yb\n0.174542 0.174542 0.174542 Yb\n0.325458 0.825458 0.674542 Yb\n0.069852 0.430148 0.569852 Yb\n0.323230 0.176770 0.823230 Yb\n0.674542 0.325458 0.825458 Yb\n0.676770 0.676770 0.676770 Yb\n0.569852 0.069852 0.430148 Yb\n0.430148 0.569852 0.069852 Yb\n0.070571 0.570571 0.929429 Dy\n0.929429 0.070571 0.570571 Dy\n0.429429 0.429429 0.429429 Dy\n0.570571 0.929429 0.070571 Dy\n0.746342 0.370426 0.500357 Sb\n0.870426 0.999643 0.253658 Sb\n0.000357 0.753658 0.629574 Sb\n0.246342 0.129574 0.499643 Sb\n0.129574 0.499643 0.246342 Sb\n0.999643 0.253658 0.870426 Sb\n0.253658 0.870426 0.999643 Sb\n0.370426 0.500357 0.746342 Sb\n0.499643 0.246342 0.129574 Sb\n0.753658 0.629574 0.000357 Sb\n0.629574 0.000357 0.753658 Sb\n0.500357 0.746342 0.370426 Sb\n",
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{
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{
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{
"id": "mp-772713",
"created_at": "2022-09-04T14:40:24.748718Z",
"structure_string": "Na6 Si2 Sb2 C2 O14\n1.0\n7.072280 0.000000 0.000000\n0.000000 5.122071 0.000000\n0.000000 0.172970 9.487071\nNa Si Sb C O\n6 2 2 2 14\ndirect\n0.250000 0.779115 0.911064 Na\n0.006920 0.251935 0.750086 Na\n0.493080 0.251935 0.750086 Na\n0.506920 0.748065 0.249914 Na\n0.993080 0.748065 0.249914 Na\n0.750000 0.220885 0.088936 Na\n0.250000 0.716565 0.593255 Si\n0.750000 0.283435 0.406745 Si\n0.750000 0.766196 0.633793 Sb\n0.250000 0.233804 0.366207 Sb\n0.750000 0.725245 0.950389 C\n0.250000 0.274755 0.049611 C\n0.250000 0.258821 0.912817 O\n0.750000 0.942691 0.874242 O\n0.750000 0.499767 0.891086 O\n0.063553 0.809157 0.682841 O\n0.436447 0.809157 0.682841 O\n0.250000 0.392722 0.581668 O\n0.750000 0.157938 0.572274 O\n0.250000 0.842062 0.427726 O\n0.750000 0.607278 0.418332 O\n0.563553 0.190843 0.317159 O\n0.936447 0.190843 0.317159 O\n0.250000 0.500233 0.108914 O\n0.250000 0.057309 0.125758 O\n0.750000 0.741179 0.087183 O\n",
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"formula_full": "Na6 Si2 Sb2 C2 O14",
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"total_magnetization": 2.68e-05,
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"updated_at": "2021-11-28T01:34:55.042000Z",
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}
]
}