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{
"id": "mp-772237",
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"structure_string": "Na2 Li10 Fe4 P4 C4 O28\n1.0\n6.531174 0.000000 0.000000\n0.000000 8.547314 0.000000\n0.000000 0.718795 10.050244\nNa Li Fe P C O\n2 10 4 4 4 28\ndirect\n0.001291 0.255496 0.627444 Na\n0.501291 0.744504 0.372556 Na\n0.262661 0.090490 0.877374 Li\n0.241643 0.088032 0.373424 Li\n0.477437 0.276172 0.620530 Li\n0.019654 0.273339 0.124553 Li\n0.478446 0.273250 0.124223 Li\n0.519654 0.726661 0.875447 Li\n0.978446 0.726750 0.875777 Li\n0.977437 0.723828 0.379470 Li\n0.741643 0.911968 0.626576 Li\n0.762661 0.909510 0.122626 Li\n0.751652 0.336622 0.896389 Fe\n0.743245 0.342806 0.390786 Fe\n0.243245 0.657194 0.609214 Fe\n0.251652 0.663378 0.103611 Fe\n0.256975 0.410859 0.858188 P\n0.243078 0.408888 0.354110 P\n0.743078 0.591112 0.645890 P\n0.756975 0.589141 0.141812 P\n0.747628 0.033934 0.858856 C\n0.758213 0.041141 0.353124 C\n0.258213 0.958859 0.646876 C\n0.247628 0.966066 0.141144 C\n0.282477 0.101321 0.678645 O\n0.245063 0.111962 0.168885 O\n0.754125 0.075114 0.979796 O\n0.755326 0.076396 0.476868 O\n0.743610 0.143005 0.760971 O\n0.735647 0.152737 0.258647 O\n0.065786 0.309944 0.902280 O\n0.438895 0.308844 0.916378 O\n0.057138 0.301210 0.394234 O\n0.430213 0.311590 0.410498 O\n0.270778 0.427532 0.703208 O\n0.728516 0.429125 0.588447 O\n0.256245 0.430172 0.198852 O\n0.754261 0.423286 0.090778 O\n0.254261 0.576714 0.909222 O\n0.756245 0.569828 0.801148 O\n0.228516 0.570875 0.411553 O\n0.770778 0.572468 0.296792 O\n0.557138 0.698790 0.605766 O\n0.930213 0.688410 0.589502 O\n0.565786 0.690056 0.097720 O\n0.938895 0.691156 0.083622 O\n0.235647 0.847263 0.741353 O\n0.243610 0.856995 0.239029 O\n0.255326 0.923604 0.523132 O\n0.254125 0.924886 0.020204 O\n0.745063 0.888038 0.831115 O\n0.782477 0.898679 0.321355 O\n",
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"formula_full": "Na2 Li10 Fe4 P4 C4 O28",
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"spacegroup": 4
},
{
"id": "mp-1232990",
"created_at": "2022-09-04T14:45:13.468395Z",
"structure_string": "K1 Li1 Ni2 H3 Se2 O10\n1.0\n4.029052 3.318053 -1.780177\n4.578368 -4.415687 -2.468214\n0.493659 -0.827690 -7.978234\nK Li Ni H Se O\n1 1 2 3 2 10\ndirect\n0.437928 0.534826 0.519817 K\n0.191175 0.195139 0.041899 Li\n0.942915 0.551750 0.043742 Ni\n0.541119 0.908977 0.989895 Ni\n0.696196 0.698585 0.782828 H\n0.285585 0.324231 0.234983 H\n0.446927 0.508467 0.019729 H\n0.882441 0.917864 0.282904 Se\n0.113105 0.055234 0.713663 Se\n0.810038 0.764868 0.523944 O\n0.230701 0.200540 0.481571 O\n0.219534 0.875335 0.220834 O\n0.849745 0.218954 0.196763 O\n0.800752 0.132353 0.779733 O\n0.161118 0.779964 0.782946 O\n0.643443 0.651596 0.924313 O\n0.290944 0.405746 0.094384 O\n0.774873 0.747570 0.172488 O\n0.279225 0.125766 0.824563 O\n",
"nsites": 19,
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],
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"density_atomic": 0.07488215587354427,
"volume": 253.73201102924799,
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"formula_full": "K1 Li1 Ni2 H3 Se2 O10",
"formula_reduced": "KLiNi2H3(SeO5)2",
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"updated_at": "2021-11-28T01:36:56.666000Z",
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},
{
"id": "mp-556641",
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"structure_string": "Na16 Li8 Al8 P16 H16 O72\n1.0\n7.031867 0.000000 0.000000\n0.000000 14.208609 0.000000\n0.000000 0.000000 14.247314\nNa Li Al P H O\n16 8 8 16 16 72\ndirect\n0.958733 0.000000 0.250000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.250000 0.753593 Na\n0.500000 0.000000 0.500000 Na\n0.041267 0.500000 0.250000 Na\n0.000000 0.750000 0.246407 Na\n0.041267 0.000000 0.750000 Na\n0.500000 0.000000 0.000000 Na\n0.500000 0.250000 0.479287 Na\n0.500000 0.750000 0.020713 Na\n0.500000 0.750000 0.520713 Na\n0.000000 0.750000 0.746407 Na\n0.000000 0.250000 0.253593 Na\n0.500000 0.500000 0.500000 Na\n0.958733 0.500000 0.750000 Na\n0.500000 0.250000 0.979287 Na\n0.260037 0.125788 0.125824 Li\n0.260037 0.874212 0.374176 Li\n0.260037 0.374212 0.625824 Li\n0.739963 0.874212 0.874176 Li\n0.739963 0.125788 0.625824 Li\n0.260037 0.625788 0.874176 Li\n0.739963 0.625788 0.374176 Li\n0.739963 0.374212 0.125824 Li\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.250000 0.498902 Al\n0.000000 0.750000 0.501098 Al\n0.000000 0.500000 0.000000 Al\n0.000000 0.250000 0.998902 Al\n0.000000 0.750000 0.001098 Al\n0.000000 0.000000 0.500000 Al\n0.278110 0.870316 0.868092 P\n0.261111 0.379056 0.856488 P\n0.721890 0.370316 0.631908 P\n0.721890 0.870316 0.368092 P\n0.261111 0.879056 0.143512 P\n0.738889 0.879056 0.643512 P\n0.261111 0.120944 0.356488 P\n0.721890 0.629684 0.868092 P\n0.278110 0.370316 0.131908 P\n0.721890 0.129684 0.131908 P\n0.738889 0.120944 0.856488 P\n0.278110 0.629684 0.368092 P\n0.278110 0.129684 0.631908 P\n0.738889 0.379056 0.356488 P\n0.261111 0.620944 0.643512 P\n0.738889 0.620944 0.143512 P\n0.589444 0.126432 0.296784 H\n0.410556 0.126432 0.796784 H\n0.199331 0.125393 0.940279 H\n0.800669 0.125393 0.440279 H\n0.800669 0.625393 0.559721 H\n0.800669 0.874607 0.059721 H\n0.410556 0.373568 0.296784 H\n0.410556 0.626432 0.203216 H\n0.199331 0.374607 0.440279 H\n0.589444 0.626432 0.703216 H\n0.410556 0.873568 0.703216 H\n0.589444 0.373568 0.796784 H\n0.199331 0.874607 0.559721 H\n0.589444 0.873568 0.203216 H\n0.800669 0.374607 0.940279 H\n0.199331 0.625393 0.059721 H\n0.194704 0.469071 0.910354 O\n0.837858 0.458492 0.599408 O\n0.479179 0.628589 0.408312 O\n0.886584 0.124734 0.494196 O\n0.171589 0.279707 0.098675 O\n0.828411 0.220293 0.098675 O\n0.515914 0.876709 0.637001 O\n0.185054 0.211134 0.407194 O\n0.805296 0.030929 0.910354 O\n0.484086 0.623291 0.637001 O\n0.275128 0.629528 0.258675 O\n0.162142 0.458492 0.099408 O\n0.484086 0.876709 0.137001 O\n0.515914 0.623291 0.137001 O\n0.814946 0.711134 0.092806 O\n0.162142 0.958492 0.900592 O\n0.808845 0.118964 0.755338 O\n0.185054 0.711134 0.592806 O\n0.886584 0.875266 0.005804 O\n0.484086 0.376709 0.862999 O\n0.479179 0.871411 0.908312 O\n0.191155 0.381036 0.755338 O\n0.171589 0.720293 0.401325 O\n0.520821 0.871411 0.408312 O\n0.886584 0.624734 0.505804 O\n0.808845 0.381036 0.255338 O\n0.520821 0.128589 0.091688 O\n0.113416 0.375266 0.494196 O\n0.275128 0.870472 0.758675 O\n0.194704 0.530929 0.589646 O\n0.805296 0.969071 0.589646 O\n0.828411 0.279707 0.598675 O\n0.113416 0.124734 0.994196 O\n0.520821 0.628589 0.908312 O\n0.828411 0.720293 0.901325 O\n0.837858 0.958492 0.400592 O\n0.724872 0.629528 0.758675 O\n0.724872 0.129528 0.241325 O\n0.479179 0.128589 0.591688 O\n0.479179 0.371411 0.091688 O\n0.837858 0.041508 0.099408 O\n0.515914 0.123291 0.862999 O\n0.194704 0.030929 0.410354 O\n0.275128 0.129528 0.741325 O\n0.275128 0.370472 0.241325 O\n0.484086 0.123291 0.362999 O\n0.113416 0.624734 0.005804 O\n0.162142 0.041508 0.599408 O\n0.837858 0.541508 0.900592 O\n0.808845 0.881036 0.744662 O\n0.886584 0.375266 0.994196 O\n0.515914 0.376709 0.362999 O\n0.194704 0.969071 0.089646 O\n0.185054 0.788866 0.092806 O\n0.724872 0.870472 0.258675 O\n0.828411 0.779707 0.401325 O\n0.185054 0.288866 0.907194 O\n0.724872 0.370472 0.741325 O\n0.113416 0.875266 0.505804 O\n0.814946 0.788866 0.592806 O\n0.805296 0.469071 0.410354 O\n0.171589 0.779707 0.901325 O\n0.814946 0.211134 0.907194 O\n0.191155 0.618964 0.744662 O\n0.191155 0.881036 0.244662 O\n0.805296 0.530929 0.089646 O\n0.814946 0.288866 0.407194 O\n0.171589 0.220293 0.598675 O\n0.162142 0.541508 0.400592 O\n0.191155 0.118964 0.255338 O\n0.520821 0.371411 0.591688 O\n0.808845 0.618964 0.244662 O\n",
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"spacegroup": 54
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{
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"structure_string": "Ca2 Mg2 U2 H48 C6 O46\n1.0\n14.790463 0.000000 0.000000\n0.000000 6.490482 0.000000\n0.000000 1.888019 11.060418\nCa Mg U H C O\n2 2 2 48 6 46\ndirect\n0.250000 0.220416 0.586439 Ca\n0.750000 0.779584 0.413561 Ca\n0.500000 0.000000 0.000000 Mg\n0.000000 0.000000 0.000000 Mg\n0.250000 0.449113 0.220303 U\n0.750000 0.550887 0.779697 U\n0.250000 0.901468 0.404826 H\n0.750000 0.098532 0.595174 H\n0.250000 0.761370 0.533318 H\n0.750000 0.238630 0.466682 H\n0.250000 0.895269 0.808247 H\n0.750000 0.104731 0.191753 H\n0.250000 0.091093 0.866959 H\n0.750000 0.908907 0.133041 H\n0.449398 0.166575 0.557255 H\n0.949398 0.833425 0.442745 H\n0.550602 0.833425 0.442745 H\n0.050602 0.166575 0.557255 H\n0.441056 0.935918 0.621084 H\n0.941056 0.064082 0.378916 H\n0.558944 0.064082 0.378916 H\n0.058944 0.935918 0.621084 H\n0.330610 0.528315 0.730916 H\n0.830610 0.471685 0.269084 H\n0.669390 0.471685 0.269084 H\n0.169390 0.528315 0.730916 H\n0.405419 0.553300 0.627856 H\n0.905419 0.446700 0.372144 H\n0.594581 0.446700 0.372144 H\n0.094581 0.553300 0.627856 H\n0.416353 0.653628 0.946620 H\n0.916353 0.346372 0.053380 H\n0.583647 0.346372 0.053380 H\n0.083647 0.653628 0.946620 H\n0.506757 0.676526 0.863105 H\n0.006757 0.323474 0.136895 H\n0.493243 0.323474 0.136895 H\n0.993243 0.676526 0.863105 H\n0.478509 0.676067 0.195559 H\n0.978509 0.323933 0.804441 H\n0.521491 0.323933 0.804441 H\n0.021491 0.676067 0.195559 H\n0.534503 0.862491 0.240348 H\n0.034503 0.137509 0.759652 H\n0.465497 0.137509 0.759652 H\n0.965497 0.862491 0.240348 H\n0.334987 0.000445 0.100025 H\n0.834987 0.999555 0.899975 H\n0.665013 0.999555 0.899975 H\n0.165013 0.000445 0.100025 H\n0.350744 0.202557 0.007566 H\n0.850744 0.797443 0.992434 H\n0.649256 0.797443 0.992434 H\n0.149256 0.202557 0.007566 H\n0.250000 0.547143 0.955085 C\n0.750000 0.452857 0.044915 C\n0.418870 0.364216 0.354488 C\n0.918870 0.635784 0.645512 C\n0.581130 0.635784 0.645512 C\n0.081130 0.364216 0.354488 C\n0.250000 0.726944 0.228457 O\n0.750000 0.273056 0.771543 O\n0.250000 0.171113 0.209664 O\n0.750000 0.828887 0.790336 O\n0.324640 0.509920 0.018335 O\n0.824640 0.490080 0.981665 O\n0.675360 0.490080 0.981665 O\n0.175360 0.509920 0.018335 O\n0.250000 0.612379 0.841869 O\n0.750000 0.387621 0.158131 O\n0.418619 0.432969 0.237067 O\n0.918619 0.567031 0.762933 O\n0.581381 0.567031 0.762933 O\n0.081381 0.432969 0.237067 O\n0.338829 0.360793 0.404074 O\n0.838829 0.639207 0.595926 O\n0.661171 0.639207 0.595926 O\n0.161171 0.360793 0.404074 O\n0.489914 0.304946 0.414182 O\n0.989914 0.695054 0.585818 O\n0.510086 0.695054 0.585818 O\n0.010086 0.304946 0.414182 O\n0.250000 0.906355 0.491330 O\n0.750000 0.093645 0.508670 O\n0.250000 0.049525 0.788151 O\n0.750000 0.950475 0.211849 O\n0.420577 0.077065 0.628027 O\n0.920577 0.922935 0.371973 O\n0.579423 0.922935 0.371973 O\n0.079423 0.077065 0.628027 O\n0.345364 0.492555 0.651519 O\n0.845364 0.507445 0.348481 O\n0.654636 0.507445 0.348481 O\n0.154636 0.492555 0.651519 O\n0.467825 0.745847 0.916214 O\n0.967825 0.254153 0.083786 O\n0.532175 0.254153 0.083786 O\n0.032175 0.745847 0.916214 O\n0.504252 0.816976 0.169512 O\n0.004252 0.183024 0.830488 O\n0.495748 0.183024 0.830488 O\n0.995748 0.816976 0.169512 O\n0.359730 0.050502 0.019284 O\n0.859730 0.949498 0.980716 O\n0.640270 0.949498 0.980716 O\n0.140270 0.050502 0.019284 O\n",
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"formula_full": "Ca2 Mg2 U2 H48 C6 O46",
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{
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"structure_string": "Fe2 P6 H36 C12 S12 O12\n1.0\n5.655234 7.279767 0.000000\n-5.655234 7.279767 0.000000\n0.000000 1.736011 13.222261\nFe P H C S O\n2 6 36 12 12 12\ndirect\n0.163236 0.836764 0.750000 Fe\n0.836764 0.163236 0.250000 Fe\n0.432169 0.567831 0.750000 P\n0.567831 0.432169 0.250000 P\n0.857817 0.794554 0.851211 P\n0.205446 0.142183 0.648789 P\n0.142183 0.205446 0.148789 P\n0.794554 0.857817 0.351211 P\n0.437222 0.311854 0.965962 H\n0.688146 0.562778 0.534038 H\n0.562778 0.688146 0.034038 H\n0.311854 0.437222 0.465962 H\n0.322057 0.498657 0.951342 H\n0.501343 0.677943 0.548658 H\n0.677943 0.501343 0.048658 H\n0.498657 0.322057 0.451342 H\n0.282219 0.350479 0.888628 H\n0.649521 0.717781 0.611372 H\n0.717781 0.649521 0.111372 H\n0.350479 0.282219 0.388628 H\n0.807826 0.427861 0.840731 H\n0.572139 0.192174 0.659269 H\n0.192174 0.572139 0.159269 H\n0.427861 0.807826 0.340731 H\n0.978911 0.463538 0.873210 H\n0.536462 0.021089 0.626790 H\n0.021089 0.536462 0.126790 H\n0.463538 0.978911 0.373210 H\n0.917720 0.519978 0.748108 H\n0.480022 0.082280 0.751892 H\n0.082280 0.480022 0.251892 H\n0.519978 0.917720 0.248108 H\n0.716494 0.121493 0.851987 H\n0.878507 0.283506 0.648013 H\n0.283506 0.878507 0.148013 H\n0.121493 0.716494 0.351987 H\n0.808228 0.052899 0.966398 H\n0.947101 0.191772 0.533602 H\n0.191772 0.947101 0.033602 H\n0.052899 0.808228 0.466398 H\n0.607261 0.094605 0.969164 H\n0.905395 0.392739 0.530836 H\n0.392739 0.905395 0.030836 H\n0.094605 0.607261 0.469164 H\n0.371139 0.395348 0.913601 C\n0.604652 0.628861 0.586399 C\n0.628861 0.604652 0.086399 C\n0.395348 0.371139 0.413601 C\n0.881002 0.506574 0.828749 C\n0.493426 0.118998 0.671251 C\n0.118998 0.493426 0.171251 C\n0.506574 0.881002 0.328749 C\n0.712369 0.051586 0.923731 C\n0.948414 0.287631 0.576269 C\n0.287631 0.948414 0.076269 C\n0.051586 0.712369 0.423731 C\n0.238630 0.592242 0.685951 S\n0.407758 0.761370 0.814049 S\n0.761370 0.407758 0.314049 S\n0.592242 0.238630 0.185951 S\n0.039982 0.768575 0.925302 S\n0.231425 0.960018 0.574698 S\n0.960018 0.231425 0.074698 S\n0.768575 0.039982 0.425302 S\n0.898173 0.864061 0.705659 S\n0.135939 0.101827 0.794341 S\n0.101827 0.135939 0.294341 S\n0.864061 0.898173 0.205659 S\n0.474689 0.422213 0.827127 O\n0.577787 0.525311 0.672873 O\n0.525311 0.577787 0.172873 O\n0.422213 0.474689 0.327127 O\n0.791472 0.647139 0.863083 O\n0.352861 0.208528 0.636917 O\n0.208528 0.352861 0.136917 O\n0.647139 0.791472 0.363083 O\n0.711510 0.900289 0.905266 O\n0.099711 0.288490 0.594734 O\n0.288490 0.099711 0.094734 O\n0.900289 0.711510 0.405266 O\n",
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"elements": [
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],
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"density": 1.6087269552751902,
"density_atomic": 0.07348288634967662,
"volume": 1088.688863136254,
"volume_molar": 8.19529697206362,
"formula_full": "Fe2 P6 H36 C12 S12 O12",
"formula_reduced": "FeP3H18C6(SO)6",
"formula_anonymous": "AB3C6D6E6F18",
"energy": -443.39085975,
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"updated_at": "2021-11-28T01:37:07.609000Z",
"spacegroup": 15
},
{
"id": "mp-772639",
"created_at": "2022-09-04T14:45:22.692238Z",
"structure_string": "Na10 Li2 Mn4 P4 C4 O28\n1.0\n6.812774 0.000000 0.000000\n-0.036663 8.962663 0.000000\n-0.020245 -0.021610 10.329746\nNa Li Mn P C O\n10 2 4 4 4 28\ndirect\n0.250115 0.917126 0.879738 Na\n0.248902 0.917647 0.380579 Na\n0.001726 0.741499 0.624180 Na\n0.498384 0.741462 0.624063 Na\n0.002322 0.740710 0.123957 Na\n0.497759 0.740590 0.123860 Na\n0.501838 0.259126 0.875372 Na\n0.998179 0.258958 0.875486 Na\n0.502624 0.258509 0.376876 Na\n0.751034 0.083720 0.120599 Na\n0.994327 0.264114 0.378686 Li\n0.751114 0.083919 0.619744 Li\n0.749990 0.638698 0.888538 Mn\n0.750152 0.638207 0.388792 Mn\n0.248380 0.359085 0.610282 Mn\n0.249135 0.360369 0.112320 Mn\n0.249941 0.588841 0.850842 P\n0.247313 0.587414 0.350722 P\n0.750063 0.407363 0.647815 P\n0.752078 0.409661 0.149935 P\n0.750044 0.941098 0.865207 C\n0.753786 0.945718 0.370868 C\n0.249277 0.059946 0.631608 C\n0.248749 0.060218 0.132897 C\n0.250327 0.916572 0.641962 O\n0.250350 0.916686 0.143207 O\n0.750245 0.879496 0.979730 O\n0.749602 0.887595 0.486570 O\n0.750212 0.856288 0.762881 O\n0.749518 0.857987 0.269646 O\n0.067184 0.681238 0.892146 O\n0.433447 0.681631 0.892316 O\n0.066316 0.681472 0.392339 O\n0.432455 0.677669 0.393476 O\n0.249696 0.571079 0.700074 O\n0.750043 0.566291 0.588117 O\n0.249534 0.572322 0.200041 O\n0.750204 0.568862 0.090850 O\n0.250016 0.430793 0.911375 O\n0.751775 0.426968 0.798355 O\n0.240140 0.426948 0.408544 O\n0.757908 0.424101 0.301304 O\n0.567130 0.313122 0.607576 O\n0.930500 0.312829 0.604538 O\n0.567222 0.318380 0.108774 O\n0.933477 0.318136 0.106093 O\n0.249382 0.144281 0.734829 O\n0.246348 0.144831 0.235991 O\n0.248217 0.123324 0.517878 O\n0.249905 0.123007 0.018974 O\n0.749738 0.084692 0.852405 O\n0.761874 0.089404 0.357045 O\n",
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"formula_full": "Na10 Li2 Mn4 P4 C4 O28",
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{
"id": "mp-1218309",
"created_at": "2022-09-04T14:45:24.038358Z",
"structure_string": "Sr1 La2 Ce1 Mn2 Cr2 O12\n1.0\n5.520432 0.000000 0.000000\n-2.694993 4.833891 0.000000\n-2.556198 -1.555103 9.165077\nSr La Ce Mn Cr O\n1 2 1 2 2 12\ndirect\n0.742536 0.870159 0.621060 Sr\n0.753963 0.377518 0.129138 La\n0.256500 0.129600 0.380032 La\n0.242370 0.620731 0.870788 Ce\n0.502399 0.254468 0.753714 Mn\n0.997169 0.498332 0.500237 Mn\n0.492741 0.744315 0.246249 Cr\n0.001356 0.998189 0.999047 Cr\n0.170004 0.791340 0.117364 O\n0.187902 0.330103 0.628175 O\n0.737865 0.146948 0.333462 O\n0.748909 0.655944 0.843304 O\n0.307593 0.655788 0.404264 O\n0.334034 0.161174 0.914929 O\n0.247460 0.327429 0.163292 O\n0.262159 0.850684 0.677456 O\n0.650098 0.828896 0.072515 O\n0.678192 0.335980 0.593187 O\n0.822747 0.693013 0.368349 O\n0.864003 0.229388 0.883438 O\n",
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"formula_full": "Sr1 La2 Ce1 Mn2 Cr2 O12",
"formula_reduced": "SrLa2CeMn2Cr2O12",
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},
{
"id": "mp-863023",
"created_at": "2022-09-04T14:45:25.084214Z",
"structure_string": "Rb2 Zn2 H4 Se4 Cl2 O12\n1.0\n6.107845 0.000000 0.000000\n0.000000 6.536718 0.000000\n0.000000 2.494960 10.660308\nRb Zn H Se Cl O\n2 2 4 4 2 12\ndirect\n0.835052 0.000000 0.250000 Rb\n0.164948 0.000000 0.750000 Rb\n0.433518 0.500000 0.250000 Zn\n0.566482 0.500000 0.750000 Zn\n0.338628 0.932218 0.089994 H\n0.338628 0.067782 0.410006 H\n0.661372 0.932218 0.589994 H\n0.661372 0.067782 0.910006 H\n0.312153 0.296782 0.010029 Se\n0.312153 0.703218 0.489971 Se\n0.687847 0.296782 0.510029 Se\n0.687847 0.703218 0.989971 Se\n0.055717 0.500000 0.250000 Cl\n0.944283 0.500000 0.750000 Cl\n0.212864 0.036353 0.076337 O\n0.515256 0.320027 0.114174 O\n0.543389 0.757355 0.115689 O\n0.543389 0.242645 0.384311 O\n0.515256 0.679973 0.385826 O\n0.212864 0.963647 0.423663 O\n0.787136 0.036353 0.576337 O\n0.484744 0.320027 0.614174 O\n0.456611 0.757355 0.615689 O\n0.456611 0.242645 0.884311 O\n0.484744 0.679973 0.885826 O\n0.787136 0.963647 0.923663 O\n",
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"elements": [
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],
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"density": 3.4509708255175218,
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"formula_full": "Rb2 Zn2 H4 Se4 Cl2 O12",
"formula_reduced": "RbZnH2Se2ClO6",
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"updated_at": "2021-11-28T01:36:59.764000Z",
"spacegroup": 13
}
]
}