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{
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{
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{
"id": "mp-1176992",
"created_at": "2022-09-04T14:47:42.632965Z",
"structure_string": "Li12 Mn2 V6 P12 O48\n1.0\n8.703432 0.000000 0.000000\n0.016175 8.767280 0.000000\n0.140911 0.055995 12.276222\nLi Mn V P O\n12 2 6 12 48\ndirect\n0.077380 0.903896 0.303396 Li\n0.078409 0.295973 0.242334 Li\n0.212396 0.227727 0.820528 Li\n0.290207 0.726264 0.677701 Li\n0.419479 0.797663 0.256394 Li\n0.420957 0.406428 0.196688 Li\n0.581943 0.592390 0.803755 Li\n0.578884 0.205650 0.742059 Li\n0.707382 0.275537 0.322759 Li\n0.791398 0.774033 0.177191 Li\n0.917224 0.702558 0.758994 Li\n0.921732 0.095037 0.698406 Li\n0.253398 0.041247 0.609516 Mn\n0.752987 0.533466 0.606494 Mn\n0.246566 0.467524 0.390176 V\n0.247523 0.542000 0.888238 V\n0.252641 0.968750 0.109107 V\n0.745400 0.958668 0.388441 V\n0.746736 0.032863 0.889959 V\n0.753599 0.458556 0.111153 V\n0.035074 0.745408 0.505486 P\n0.105706 0.611800 0.147082 P\n0.107556 0.902375 0.848488 P\n0.392617 0.111304 0.354829 P\n0.399893 0.405386 0.649426 P\n0.460984 0.251787 0.993578 P\n0.539008 0.748715 0.005787 P\n0.603008 0.600068 0.347926 P\n0.604297 0.889172 0.646810 P\n0.893693 0.099045 0.149349 P\n0.896091 0.388243 0.855814 P\n0.960838 0.247379 0.494437 P\n0.051446 0.132682 0.567316 O\n0.064561 0.322547 0.406238 O\n0.070863 0.407244 0.832956 O\n0.072864 0.105549 0.151881 O\n0.108435 0.634637 0.423181 O\n0.148373 0.585387 0.027849 O\n0.148977 0.778309 0.180931 O\n0.154300 0.025329 0.759920 O\n0.157602 0.740068 0.812065 O\n0.160782 0.823072 0.571451 O\n0.172592 0.950899 0.956464 O\n0.193342 0.491350 0.217964 O\n0.303741 0.991589 0.285580 O\n0.332329 0.450582 0.540989 O\n0.332143 0.333842 0.930609 O\n0.353860 0.244786 0.690528 O\n0.349939 0.277733 0.320030 O\n0.354632 0.528432 0.736652 O\n0.357267 0.087364 0.476320 O\n0.385426 0.139373 0.074819 O\n0.423807 0.607127 0.345258 O\n0.427701 0.906730 0.665585 O\n0.434903 0.824922 0.093426 O\n0.449802 0.635948 0.933694 O\n0.550058 0.364186 0.065981 O\n0.564831 0.175438 0.906133 O\n0.567544 0.093677 0.333508 O\n0.580786 0.399797 0.650904 O\n0.614873 0.860733 0.924967 O\n0.647028 0.915389 0.527333 O\n0.646435 0.477748 0.259374 O\n0.647332 0.723333 0.682091 O\n0.654094 0.762731 0.310621 O\n0.668291 0.666314 0.068755 O\n0.670503 0.549220 0.454074 O\n0.690847 0.009190 0.717339 O\n0.805160 0.510061 0.790625 O\n0.827768 0.050556 0.041881 O\n0.832102 0.164655 0.431566 O\n0.842047 0.260173 0.188467 O\n0.850053 0.976043 0.237861 O\n0.853098 0.222357 0.819917 O\n0.859286 0.407226 0.977224 O\n0.888241 0.357764 0.577070 O\n0.928415 0.898052 0.844749 O\n0.930755 0.594413 0.167825 O\n0.929183 0.667899 0.593726 O\n0.946575 0.860634 0.433997 O\n",
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],
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"density_atomic": 0.08540235293257877,
"volume": 936.7423408481067,
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"formula_full": "Li12 Mn2 V6 P12 O48",
"formula_reduced": "Li6MnV3(PO4)6",
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"spacegroup": 1
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{
"id": "mp-13906",
"created_at": "2022-09-04T14:47:42.849583Z",
"structure_string": "Cu1 Sn1 F6\n1.0\n4.912187 -2.653448 0.000000\n4.912187 2.653448 0.000000\n3.478857 0.000000 4.366684\nCu Sn F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Sn\n0.865170 0.249502 0.637386 F\n0.637386 0.865170 0.249502 F\n0.750498 0.362614 0.134830 F\n0.362614 0.134830 0.750498 F\n0.134830 0.750498 0.362614 F\n0.249502 0.637386 0.865170 F\n",
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"formula_full": "Cu1 Sn1 F6",
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{
"id": "mp-1185187",
"created_at": "2022-09-04T14:47:43.032195Z",
"structure_string": "Li3 Mo1\n1.0\n4.015207 0.000000 0.000000\n0.000000 4.015207 0.000000\n0.000000 0.000000 4.015207\nLi Mo\n3 1\ndirect\n0.000000 0.500000 0.500000 Li\n0.500000 0.000000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Mo\n",
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{
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"structure_string": "Y2 Sn4 O8\n1.0\n-3.066193 3.066193 5.318341\n3.066193 -3.066193 5.318341\n3.066193 3.066193 -5.318341\nY Sn O\n2 4 8\ndirect\n0.000000 0.000000 0.000000 Y\n0.750000 0.250000 0.500000 Y\n0.375000 0.125000 0.750000 Sn\n0.375000 0.625000 0.250000 Sn\n0.875000 0.625000 0.250000 Sn\n0.375000 0.625000 0.750000 Sn\n0.125004 0.622126 0.848707 O\n0.773419 0.276297 0.151293 O\n0.624996 0.627874 0.651293 O\n0.976581 0.973703 0.348707 O\n0.372126 0.023419 0.997122 O\n0.026297 0.375004 0.002878 O\n0.723703 0.874996 0.497122 O\n0.377874 0.226581 0.502878 O\n",
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{
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{
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{
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"structure_string": "Ba4 Ca4 Sn4 F28\n1.0\n10.799827 0.000000 0.000000\n0.000000 5.915307 0.000000\n0.000000 0.290106 9.947903\nBa Ca Sn F\n4 4 4 28\ndirect\n0.320122 0.731591 0.502414 Ba\n0.820122 0.268409 0.997586 Ba\n0.679878 0.268409 0.497586 Ba\n0.179878 0.731591 0.002414 Ba\n0.415452 0.287522 0.818374 Ca\n0.915452 0.712478 0.681626 Ca\n0.084548 0.287522 0.318374 Ca\n0.584548 0.712478 0.181626 Ca\n0.607740 0.780697 0.793179 Sn\n0.392260 0.219303 0.206821 Sn\n0.892260 0.780697 0.293179 Sn\n0.107740 0.219303 0.706821 Sn\n0.415792 0.906631 0.106533 F\n0.051327 0.645001 0.398911 F\n0.741089 0.493304 0.748991 F\n0.258911 0.506696 0.251009 F\n0.492739 0.008645 0.357337 F\n0.792639 0.717676 0.484868 F\n0.770043 0.980517 0.726227 F\n0.992739 0.991355 0.142663 F\n0.448673 0.645001 0.898911 F\n0.241089 0.506696 0.751009 F\n0.084208 0.906631 0.606533 F\n0.584208 0.093369 0.893467 F\n0.270043 0.019483 0.773773 F\n0.996384 0.513652 0.858991 F\n0.507261 0.991355 0.642663 F\n0.007261 0.008645 0.857337 F\n0.229957 0.019483 0.273773 F\n0.915792 0.093369 0.393467 F\n0.496384 0.486348 0.641009 F\n0.948673 0.354999 0.601089 F\n0.003616 0.486348 0.141009 F\n0.729957 0.980517 0.226227 F\n0.503616 0.513652 0.358991 F\n0.292639 0.282324 0.015132 F\n0.207361 0.282324 0.515132 F\n0.707361 0.717676 0.984868 F\n0.551327 0.354999 0.101089 F\n0.758911 0.493304 0.248991 F\n",
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{
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