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{
"id": "mp-557740",
"created_at": "2022-09-04T14:40:23.684857Z",
"structure_string": "Mn39 Si6 Sb3 O72\n1.0\n5.912457 -10.240675 0.000000\n5.912457 10.240675 0.000000\n0.000000 0.000000 11.159582\nMn Si Sb O\n39 6 3 72\ndirect\n0.000000 0.522456 0.257204 Mn\n0.000000 0.161937 0.729596 Mn\n0.336086 0.828935 0.722047 Mn\n0.661776 0.661776 0.490282 Mn\n0.831592 0.504321 0.489105 Mn\n0.338224 0.000000 0.490282 Mn\n0.834011 0.000000 0.501047 Mn\n0.830849 0.501121 0.990513 Mn\n0.000000 0.832813 0.991065 Mn\n0.670272 0.169151 0.990513 Mn\n0.828935 0.336086 0.722047 Mn\n0.158451 0.330210 0.258850 Mn\n0.498879 0.329728 0.990513 Mn\n0.167187 0.167187 0.991065 Mn\n0.169151 0.670272 0.990513 Mn\n0.329728 0.498879 0.990513 Mn\n0.832813 0.000000 0.991065 Mn\n0.168408 0.672729 0.489105 Mn\n0.504321 0.831592 0.489105 Mn\n0.327271 0.495679 0.489105 Mn\n0.000000 0.834011 0.501047 Mn\n0.838063 0.838063 0.729596 Mn\n0.492848 0.663914 0.722047 Mn\n0.000000 0.338224 0.490282 Mn\n0.165989 0.165989 0.501047 Mn\n0.672729 0.168408 0.489105 Mn\n0.171760 0.841549 0.258850 Mn\n0.522456 0.000000 0.257204 Mn\n0.161937 0.000000 0.729596 Mn\n0.841549 0.171760 0.258850 Mn\n0.171065 0.507152 0.722047 Mn\n0.669790 0.828240 0.258850 Mn\n0.828240 0.669790 0.258850 Mn\n0.495679 0.327271 0.489105 Mn\n0.501121 0.830849 0.990513 Mn\n0.330210 0.158451 0.258850 Mn\n0.663914 0.492848 0.722047 Mn\n0.477544 0.477544 0.257204 Mn\n0.507152 0.171065 0.722047 Mn\n0.333333 0.666667 0.233347 Si\n0.000000 0.000000 0.225975 Si\n0.667447 0.000000 0.748550 Si\n0.332553 0.332553 0.748550 Si\n0.666667 0.333333 0.233347 Si\n0.000000 0.667447 0.748550 Si\n0.659539 0.659539 0.991638 Sb\n0.000000 0.340461 0.991638 Sb\n0.340461 0.000000 0.991638 Sb\n0.661158 0.513128 0.897745 O\n0.473126 0.662650 0.543843 O\n0.459773 0.330639 0.695425 O\n0.533411 0.325705 0.284601 O\n0.851680 0.193623 0.082972 O\n0.810475 0.337350 0.543843 O\n0.662650 0.473126 0.543843 O\n0.000000 0.335352 0.692498 O\n0.816309 0.142939 0.435474 O\n0.203789 0.203789 0.697085 O\n0.330579 0.330579 0.897928 O\n0.669361 0.129134 0.695425 O\n0.148320 0.341943 0.082972 O\n0.139216 0.000000 0.555413 O\n0.000000 0.000000 0.773798 O\n0.354736 0.000000 0.290348 O\n0.513128 0.661158 0.897745 O\n0.130090 0.000000 0.274024 O\n0.461781 0.461781 0.434339 O\n0.000000 0.692252 0.224439 O\n0.507266 0.507266 0.082033 O\n0.189525 0.526874 0.543843 O\n0.326630 0.183691 0.435474 O\n0.666667 0.333333 0.083790 O\n0.645264 0.645264 0.290348 O\n0.658057 0.806377 0.082972 O\n0.000000 0.538219 0.434339 O\n0.666667 0.333333 0.758770 O\n0.526874 0.189525 0.543843 O\n0.806377 0.658057 0.082972 O\n0.000000 0.130090 0.274024 O\n0.338842 0.851970 0.897745 O\n0.669421 0.000000 0.897928 O\n0.330639 0.459773 0.695425 O\n0.000000 0.189986 0.901774 O\n0.692252 0.000000 0.224439 O\n0.337350 0.810475 0.543843 O\n0.000000 0.354736 0.290348 O\n0.325705 0.533411 0.284601 O\n0.307748 0.307748 0.224439 O\n0.333333 0.666667 0.083790 O\n0.000000 0.000000 0.075173 O\n0.193623 0.851680 0.082972 O\n0.189986 0.000000 0.901774 O\n0.335352 0.000000 0.692498 O\n0.129134 0.669361 0.695425 O\n0.207706 0.674295 0.284601 O\n0.466589 0.792294 0.284601 O\n0.792294 0.466589 0.284601 O\n0.674295 0.207706 0.284601 O\n0.492734 0.000000 0.082033 O\n0.810014 0.810014 0.901774 O\n0.000000 0.796211 0.697085 O\n0.000000 0.669421 0.897928 O\n0.142939 0.816309 0.435474 O\n0.000000 0.492734 0.082033 O\n0.486872 0.148030 0.897745 O\n0.851970 0.338842 0.897745 O\n0.673370 0.857061 0.435474 O\n0.664648 0.664648 0.692498 O\n0.796211 0.000000 0.697085 O\n0.860784 0.860784 0.555413 O\n0.148030 0.486872 0.897745 O\n0.869910 0.869910 0.274024 O\n0.341943 0.148320 0.082972 O\n0.538219 0.000000 0.434339 O\n0.857061 0.673370 0.435474 O\n0.000000 0.139216 0.555413 O\n0.333333 0.666667 0.758770 O\n0.183691 0.326630 0.435474 O\n0.540227 0.870866 0.695425 O\n0.870866 0.540227 0.695425 O\n",
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"elements": [
"Mn",
"Si",
"Sb",
"O"
],
"chemical_system": "Mn-O-Sb-Si",
"density": 4.704184702619287,
"density_atomic": 0.08879872783186074,
"volume": 1351.37071138247,
"volume_molar": 6.781787202405473,
"formula_full": "Mn39 Si6 Sb3 O72",
"formula_reduced": "Mn13Si2SbO24",
"formula_anonymous": "AB2C13D24",
"energy": -1024.86884138,
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"updated_at": "2021-11-28T01:34:55.064000Z",
"spacegroup": 157
},
{
"id": "mp-1213559",
"created_at": "2022-09-04T14:42:45.930307Z",
"structure_string": "K16 Re24 Te8 C24 S24 N24\n1.0\n-8.867923 -8.867923 8.867923\n-8.867923 8.867923 -8.867923\n8.867923 -8.867923 -8.867923\nK Re Te C S N\n16 24 8 24 24 24\ndirect\n0.000000 0.000000 -0.000000 K\n0.500000 0.000000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.000000 0.500000 0.500000 K\n0.556825 0.306825 0.750000 K\n0.443175 0.693175 0.250000 K\n0.943175 0.193175 0.250000 K\n0.306825 0.750000 0.556825 K\n0.056825 0.806825 0.750000 K\n0.693175 0.250000 0.443175 K\n0.193175 0.250000 0.943175 K\n0.806825 0.750000 0.056825 K\n0.750000 0.556825 0.306825 K\n0.250000 0.443175 0.693175 K\n0.250000 0.943175 0.193175 K\n0.750000 0.056825 0.806825 K\n0.640610 0.539798 0.529880 Re\n0.359390 0.460202 0.470120 Re\n0.859390 0.889270 0.399188 Re\n0.490082 0.960202 0.100812 Re\n0.539798 0.529880 0.640610 Re\n0.140610 0.110730 0.600812 Re\n0.509918 0.039798 0.899188 Re\n0.460202 0.470120 0.359390 Re\n0.009918 0.610730 0.970120 Re\n0.889270 0.399188 0.859390 Re\n0.990082 0.389270 0.029880 Re\n0.110730 0.600812 0.140610 Re\n0.960202 0.100812 0.490082 Re\n0.039798 0.899188 0.509918 Re\n0.610730 0.970120 0.009918 Re\n0.389270 0.029880 0.990082 Re\n0.529880 0.640610 0.539798 Re\n0.470120 0.359390 0.460202 Re\n0.100812 0.490082 0.960202 Re\n0.899188 0.509918 0.039798 Re\n0.970120 0.009918 0.610730 Re\n0.029880 0.990082 0.389270 Re\n0.399188 0.859390 0.889270 Re\n0.600812 0.140610 0.110730 Re\n0.717255 0.717255 0.717255 Te\n0.282745 0.282745 0.282745 Te\n0.782745 -0.000000 0.500000 Te\n0.500000 0.782745 -0.000000 Te\n0.217255 0.000000 0.500000 Te\n0.500000 0.217255 -0.000000 Te\n0.000000 0.500000 0.782745 Te\n-0.000000 0.500000 0.217255 Te\n0.795238 0.576504 0.560955 C\n0.204762 0.423496 0.439045 C\n0.704762 0.765716 0.281266 C\n0.484450 0.923496 0.218734 C\n0.576504 0.560955 0.795238 C\n0.295239 0.234284 0.718734 C\n0.515550 0.076504 0.781266 C\n0.423496 0.439045 0.204762 C\n0.015550 0.734284 0.939045 C\n0.765716 0.281266 0.704762 C\n0.984450 0.265716 0.060955 C\n0.234284 0.718734 0.295239 C\n0.923496 0.218734 0.484450 C\n0.076504 0.781266 0.515550 C\n0.734284 0.939045 0.015550 C\n0.265716 0.060955 0.984450 C\n0.560955 0.795238 0.576504 C\n0.439045 0.204762 0.423496 C\n0.218734 0.484450 0.923496 C\n0.781266 0.515550 0.076504 C\n0.939045 0.015550 0.734284 C\n0.060955 0.984450 0.265716 C\n0.281266 0.704762 0.765716 C\n0.718734 0.295239 0.234284 C\n0.618955 0.637530 0.436041 S\n0.381045 0.362470 0.563959 S\n0.881045 0.817086 0.518575 S\n0.298511 0.862470 0.981425 S\n0.637530 0.436041 0.618955 S\n0.118955 0.182914 0.481425 S\n0.701489 0.137530 0.018575 S\n0.362470 0.563959 0.381045 S\n0.201489 0.682914 0.063959 S\n0.817086 0.518575 0.881045 S\n0.798511 0.317086 0.936041 S\n0.182914 0.481425 0.118955 S\n0.862470 0.981425 0.298511 S\n0.137530 0.018575 0.701489 S\n0.682914 0.063959 0.201489 S\n0.317086 0.936041 0.798511 S\n0.436041 0.618955 0.637530 S\n0.563959 0.381045 0.362470 S\n0.981425 0.298511 0.862470 S\n0.018575 0.701489 0.137530 S\n0.063959 0.201489 0.682914 S\n0.936041 0.798511 0.317086 S\n0.518575 0.881045 0.817086 S\n0.481425 0.118955 0.182914 S\n0.881967 0.594705 0.578342 N\n0.118033 0.405295 0.421658 N\n0.618033 0.696376 0.212738 N\n0.483638 0.905295 0.287262 N\n0.594705 0.578342 0.881967 N\n0.381967 0.303624 0.787262 N\n0.516362 0.094705 0.712738 N\n0.405295 0.421658 0.118033 N\n0.016362 0.803624 0.921658 N\n0.696376 0.212738 0.618033 N\n0.983638 0.196376 0.078342 N\n0.303624 0.787262 0.381967 N\n0.905295 0.287262 0.483638 N\n0.094705 0.712738 0.516362 N\n0.803624 0.921658 0.016362 N\n0.196376 0.078342 0.983638 N\n0.578342 0.881967 0.594705 N\n0.421658 0.118033 0.405295 N\n0.287262 0.483638 0.905295 N\n0.712738 0.516362 0.094705 N\n0.921658 0.016362 0.803624 N\n0.078342 0.983638 0.196376 N\n0.212738 0.618033 0.696376 N\n0.787262 0.381967 0.303624 N\n",
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],
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"density": 4.470168406127336,
"density_atomic": 0.043018524885411656,
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"formula_full": "K16 Re24 Te8 C24 S24 N24",
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"updated_at": "2021-11-28T01:35:51.827000Z",
"spacegroup": 206
},
{
"id": "mp-1099972",
"created_at": "2022-09-04T14:43:51.895195Z",
"structure_string": "K16 Na16 Mo4 W28 O80\n1.0\n0.044830 0.019378 11.625844\n11.739391 -0.071361 0.045838\n-5.988071 15.581884 -5.809761\nK Na Mo W O\n16 16 4 28 80\ndirect\n0.304088 0.063473 0.108675 K\n0.301879 0.562464 0.107671 K\n0.804730 0.063696 0.111405 K\n0.801603 0.559266 0.108187 K\n0.199459 0.934182 0.392100 K\n0.192685 0.927959 0.882874 K\n0.704111 0.438175 0.396152 K\n0.690171 0.427033 0.883084 K\n0.699892 0.933325 0.394085 K\n0.057500 0.296022 0.109750 K\n0.054549 0.794964 0.106198 K\n0.558182 0.296674 0.110461 K\n0.550386 0.796880 0.105129 K\n0.451961 0.710065 0.393672 K\n0.437210 0.705183 0.882167 K\n0.944131 0.701743 0.882597 K\n0.299463 0.070569 0.602439 Na\n0.300296 0.564266 0.599736 Na\n0.803014 0.066814 0.601767 Na\n0.798921 0.569414 0.601619 Na\n0.206315 0.438213 0.404864 Na\n0.199234 0.440854 0.897705 Na\n0.698346 0.937694 0.896383 Na\n0.052158 0.284511 0.603066 Na\n0.051432 0.790353 0.601893 Na\n0.551508 0.288808 0.603326 Na\n0.553413 0.789138 0.601726 Na\n0.454652 0.215308 0.407902 Na\n0.446254 0.212251 0.895768 Na\n0.952896 0.212234 0.404684 Na\n0.944910 0.206987 0.895437 Na\n0.947522 0.710440 0.401177 Na\n0.005593 0.998926 0.996764 Mo\n0.002480 0.495053 0.994923 Mo\n0.504046 0.998148 0.995285 Mo\n0.250929 0.745274 0.993218 Mo\n0.014626 0.001651 0.503741 W\n0.014928 0.503365 0.505403 W\n0.513663 0.006482 0.506139 W\n0.503326 0.496927 0.994643 W\n0.515009 0.502669 0.506232 W\n0.253330 0.248059 0.993744 W\n0.264667 0.254732 0.505198 W\n0.263093 0.749493 0.503198 W\n0.755690 0.244788 0.995221 W\n0.768832 0.253604 0.507595 W\n0.753153 0.747526 0.993123 W\n0.765361 0.754129 0.506947 W\n0.094428 0.117485 0.255458 W\n0.085525 0.098861 0.745714 W\n0.095560 0.591631 0.254511 W\n0.088051 0.582218 0.737192 W\n0.600385 0.101815 0.258311 W\n0.584698 0.090368 0.745669 W\n0.605142 0.589330 0.249450 W\n0.585959 0.589212 0.740873 W\n0.350613 0.400497 0.257614 W\n0.336980 0.400741 0.748431 W\n0.346759 0.915170 0.251618 W\n0.340116 0.909979 0.740768 W\n0.869029 0.389371 0.256387 W\n0.845280 0.400227 0.745620 W\n0.853356 0.903897 0.252015 W\n0.836007 0.913562 0.748595 W\n0.129913 0.123907 0.490804 O\n0.122562 0.122726 0.983330 O\n0.127253 0.614565 0.482804 O\n0.124540 0.615703 0.982803 O\n0.633589 0.127028 0.496661 O\n0.632857 0.125403 0.985807 O\n0.632557 0.624063 0.495466 O\n0.622072 0.618377 0.985567 O\n0.136703 0.367480 0.998703 O\n0.148313 0.388552 0.522849 O\n0.129569 0.875614 0.001957 O\n0.146091 0.882725 0.520661 O\n0.629477 0.371011 0.000034 O\n0.648675 0.386930 0.524717 O\n0.638760 0.868149 0.999960 O\n0.648437 0.889566 0.525878 O\n0.382498 0.123605 0.489730 O\n0.370098 0.130094 0.988760 O\n0.380261 0.616819 0.491965 O\n0.370314 0.612523 0.983480 O\n0.883346 0.119862 0.488297 O\n0.874617 0.115638 0.986066 O\n0.885318 0.623869 0.494140 O\n0.865543 0.623938 0.988856 O\n0.380974 0.377073 0.001499 O\n0.398561 0.387553 0.522527 O\n0.377476 0.873918 0.003172 O\n0.398262 0.890977 0.525797 O\n0.874502 0.364209 0.998741 O\n0.901274 0.389082 0.525992 O\n0.876822 0.875479 0.000945 O\n0.897716 0.887603 0.522291 O\n0.070757 0.081532 0.132883 O\n0.086661 0.110708 0.639285 O\n0.069824 0.581806 0.139037 O\n0.095260 0.616840 0.640710 O\n0.574056 0.083890 0.138451 O\n0.582427 0.113397 0.643086 O\n0.574389 0.589448 0.135109 O\n0.587582 0.617152 0.640629 O\n0.446703 0.392360 0.367110 O\n0.437784 0.394082 0.856655 O\n0.449078 0.916526 0.366113 O\n0.447586 0.916651 0.853913 O\n0.943100 0.391561 0.370608 O\n0.935231 0.392568 0.855869 O\n0.944768 0.893601 0.364859 O\n0.942003 0.910993 0.858412 O\n0.318656 0.307320 0.132692 O\n0.339924 0.283182 0.639737 O\n0.321761 0.801199 0.138450 O\n0.336415 0.777562 0.638810 O\n0.824178 0.308534 0.127611 O\n0.852642 0.277588 0.640770 O\n0.825099 0.802110 0.131422 O\n0.839343 0.788839 0.643154 O\n0.203459 0.224399 0.368808 O\n0.197228 0.201565 0.860665 O\n0.203955 0.702771 0.367203 O\n0.186376 0.689403 0.853521 O\n0.707160 0.209847 0.370403 O\n0.702675 0.188428 0.859347 O\n0.700607 0.699203 0.368008 O\n0.689338 0.693443 0.859370 O\n0.446364 0.076363 0.272768 O\n0.418919 0.072748 0.750126 O\n0.446348 0.538127 0.248300 O\n0.418640 0.539991 0.729377 O\n0.946334 0.063559 0.269431 O\n0.920929 0.065406 0.746720 O\n0.935797 0.556723 0.258369 O\n0.917830 0.542288 0.726966 O\n0.197749 0.450572 0.271595 O\n0.171519 0.430615 0.750930 O\n0.187040 0.962379 0.251010 O\n0.171516 0.945054 0.734348 O\n0.709136 0.450904 0.256648 O\n0.677218 0.439341 0.736845 O\n0.693650 0.952207 0.249994 O\n0.668551 0.937022 0.750308 O\n",
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"elements": [
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"density": 6.104654864459953,
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"volume_molar": 8.878290054278342,
"formula_full": "K16 Na16 Mo4 W28 O80",
"formula_reduced": "K4Na4MoW7O20",
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"energy": -1102.0256464,
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"updated_at": "2021-11-28T01:36:25.828000Z",
"spacegroup": 1
},
{
"id": "mp-1205203",
"created_at": "2022-09-04T14:44:26.146210Z",
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H\n0.789919 0.100208 0.724589 H\n0.013203 0.454106 0.415759 H\n0.486797 0.954106 0.084241 H\n0.986797 0.545894 0.584241 H\n0.513203 0.045894 0.915759 H\n0.191249 0.440185 0.436590 H\n0.308751 0.940185 0.063410 H\n0.808751 0.559815 0.563410 H\n0.691249 0.059815 0.936590 H\n0.128558 0.509328 0.350123 H\n0.371442 0.009328 0.149877 H\n0.871442 0.490672 0.649877 H\n0.628558 0.990672 0.850123 H\n0.973319 0.310557 0.177735 H\n0.526681 0.810557 0.322265 H\n0.026681 0.689443 0.822265 H\n0.473319 0.189443 0.677735 H\n0.872647 0.366015 0.252198 H\n0.627353 0.866015 0.247802 H\n0.127353 0.633985 0.747802 H\n0.372647 0.133985 0.752198 H\n0.991459 0.430322 0.195564 H\n0.508541 0.930322 0.304436 H\n0.008541 0.569678 0.804436 H\n0.491459 0.069678 0.695564 H\n0.778465 0.396646 0.396622 H\n0.721535 0.896646 0.103378 H\n0.221535 0.603354 0.603378 H\n0.278465 0.103354 0.896622 H\n0.658177 0.316197 0.352067 H\n0.841823 0.816197 0.147933 H\n0.341823 0.683803 0.647933 H\n0.158177 0.183803 0.852067 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H\n0.379085 0.597586 0.277693 H\n0.879085 0.902414 0.777693 H\n0.620915 0.402414 0.722307 H\n0.983780 0.055108 0.155767 H\n0.516220 0.555108 0.344233 H\n0.016220 0.944892 0.844233 H\n0.483781 0.444892 0.655767 H\n0.642076 0.127862 0.286755 H\n0.857924 0.627862 0.213245 H\n0.357924 0.872138 0.713245 H\n0.142076 0.372138 0.786755 H\n0.713547 0.197605 0.207966 H\n0.786453 0.697605 0.292034 H\n0.286453 0.802395 0.792034 H\n0.213547 0.302395 0.707966 H\n0.696177 0.077274 0.192447 H\n0.803823 0.577274 0.307553 H\n0.303823 0.922726 0.807553 H\n0.196177 0.422726 0.692447 H\n0.003707 0.979426 0.369750 H\n0.496293 0.479426 0.130250 H\n0.996293 0.020574 0.630250 H\n0.503707 0.520574 0.869750 H\n0.825746 0.980972 0.381562 H\n0.674254 0.480972 0.118438 H\n0.174254 0.019028 0.618438 H\n0.325746 0.519028 0.881562 H\n0.891109 0.939626 0.286214 H\n0.608891 0.439626 0.213786 H\n0.108891 0.060374 0.713786 H\n0.391109 0.560374 0.786214 H\n0.279210 0.338461 0.264735 C\n0.220790 0.838461 0.235265 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"elements": [
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"formula_full": "Si12 P4 H108 C36 N8 Cl8",
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"updated_at": "2021-11-28T01:36:39.872000Z",
"spacegroup": 14
},
{
"id": "mp-567719",
"created_at": "2022-09-04T14:44:58.746895Z",
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},
{
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"nsites": 132,
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"elements": [
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],
"chemical_system": "C-H-K-Mn-O",
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"formula_full": "K12 Mn12 H8 C48 O52",
"formula_reduced": "K3Mn3H2C12O13",
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"energy": -965.19592059,
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"total_magnetization": 1.99e-05,
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"updated_at": "2021-11-28T01:36:12.967000Z",
"spacegroup": 14
},
{
"id": "mp-1199449",
"created_at": "2022-09-04T14:41:17.093062Z",
"structure_string": "Mn36 Pb16 O80\n1.0\n0.000000 -0.000000 -10.185363\n0.000000 -11.558266 0.000000\n-14.238127 0.000000 0.000000\nMn Pb O\n36 16 80\ndirect\n0.665959 0.250000 0.172060 Mn\n0.834041 0.250000 0.672060 Mn\n0.334041 0.750000 0.827940 Mn\n0.165959 0.750000 0.327940 Mn\n0.584109 0.380238 0.674998 Mn\n0.915891 0.119762 0.174998 Mn\n0.415891 0.880238 0.325002 Mn\n0.084109 0.619762 0.825002 Mn\n0.415891 0.619762 0.325002 Mn\n0.084109 0.880238 0.825002 Mn\n0.584109 0.119762 0.674998 Mn\n0.915891 0.380238 0.174998 Mn\n0.579957 0.616655 0.834160 Mn\n0.920043 0.883345 0.334160 Mn\n0.420043 0.116655 0.165840 Mn\n0.079957 0.383345 0.665840 Mn\n0.420043 0.383345 0.165840 Mn\n0.079957 0.116655 0.665840 Mn\n0.579957 0.883345 0.834160 Mn\n0.920043 0.616655 0.334160 Mn\n0.833625 0.750000 0.833455 Mn\n0.666375 0.750000 0.333455 Mn\n0.166375 0.250000 0.166545 Mn\n0.333625 0.250000 0.666545 Mn\n0.673832 0.488954 0.328611 Mn\n0.826168 0.011046 0.828611 Mn\n0.326168 0.988954 0.671389 Mn\n0.173832 0.511046 0.171389 Mn\n0.326168 0.511046 0.671389 Mn\n0.173832 0.988954 0.171389 Mn\n0.673832 0.011046 0.328611 Mn\n0.826168 0.488954 0.828611 Mn\n0.500000 -0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 -0.000000 0.000000 Mn\n0.214715 0.750000 0.559206 Pb\n0.285285 0.750000 0.059206 Pb\n0.785285 0.250000 0.440794 Pb\n0.714715 0.250000 0.940794 Pb\n0.425011 0.250000 0.392897 Pb\n0.074989 0.250000 0.892897 Pb\n0.574989 0.750000 0.607103 Pb\n0.925011 0.750000 0.107103 Pb\n0.143782 0.059895 0.426378 Pb\n0.356218 0.440105 0.926378 Pb\n0.856218 0.559895 0.573622 Pb\n0.643782 0.940105 0.073622 Pb\n0.856218 0.940105 0.573622 Pb\n0.643782 0.559895 0.073622 Pb\n0.143782 0.440105 0.426378 Pb\n0.356218 0.059895 0.926378 Pb\n0.576707 0.626790 0.403444 O\n0.923293 0.873210 0.903444 O\n0.423293 0.126790 0.596556 O\n0.076707 0.373210 0.096556 O\n0.423293 0.373210 0.596556 O\n0.076707 0.126790 0.096556 O\n0.576707 0.873210 0.403444 O\n0.923293 0.626790 0.903444 O\n0.596232 0.381810 0.418586 O\n0.903768 0.118190 0.918586 O\n0.403768 0.881810 0.581414 O\n0.096232 0.618190 0.081414 O\n0.403768 0.618190 0.581414 O\n0.096232 0.881810 0.081414 O\n0.596232 0.118190 0.418586 O\n0.903768 0.381810 0.918586 O\n0.642439 0.498775 0.588991 O\n0.857561 0.001225 0.088991 O\n0.357561 0.998775 0.411009 O\n0.142439 0.501225 0.911009 O\n0.357561 0.501225 0.411009 O\n0.142439 0.998775 0.911009 O\n0.642439 0.001225 0.588991 O\n0.857561 0.498775 0.088991 O\n0.672197 0.750000 0.904148 O\n0.827803 0.750000 0.404148 O\n0.327803 0.250000 0.095852 O\n0.172197 0.250000 0.595852 O\n0.660260 0.499761 0.908799 O\n0.839740 0.000239 0.408799 O\n0.339740 -0.000239 0.091201 O\n0.160260 0.500239 0.591201 O\n0.339740 0.500239 0.091201 O\n0.160260 -0.000239 0.591201 O\n0.660260 0.000239 0.908799 O\n0.839740 0.499761 0.408799 O\n0.826930 0.250000 0.101503 O\n0.673070 0.250000 0.601503 O\n0.173070 0.750000 0.898497 O\n0.326930 0.750000 0.398497 O\n0.919906 0.369842 0.592766 O\n0.580094 0.130158 0.092766 O\n0.080094 0.869842 0.407234 O\n0.419906 0.630158 0.907234 O\n0.080094 0.630158 0.407234 O\n0.419906 0.869842 0.907234 O\n0.919906 0.130158 0.592766 O\n0.580094 0.369842 0.092766 O\n0.496898 0.250000 0.237915 O\n0.003102 0.250000 0.737915 O\n0.503102 0.750000 0.762085 O\n0.996898 0.750000 0.262085 O\n0.501032 0.750000 0.259623 O\n0.998968 0.750000 0.759623 O\n0.498968 0.250000 0.740377 O\n0.001032 0.250000 0.240377 O\n0.745642 0.132045 0.745716 O\n0.754358 0.367955 0.245716 O\n0.254358 0.632045 0.254284 O\n0.245642 0.867955 0.754284 O\n0.254358 0.867955 0.254284 O\n0.245642 0.632045 0.754284 O\n0.745642 0.367955 0.745716 O\n0.754358 0.132045 0.245716 O\n0.507943 0.502767 0.250592 O\n0.992057 0.997233 0.750592 O\n0.492057 0.002767 0.749408 O\n0.007943 0.497233 0.249408 O\n0.492057 0.497233 0.749408 O\n0.007943 0.002767 0.249408 O\n0.507943 0.997233 0.250592 O\n0.992057 0.502767 0.750592 O\n0.753042 0.623552 0.263421 O\n0.746958 0.876448 0.763421 O\n0.246958 0.123552 0.736579 O\n0.253042 0.376448 0.236579 O\n0.246958 0.376448 0.736579 O\n0.253042 0.123552 0.236579 O\n0.753042 0.876448 0.263421 O\n0.746958 0.623552 0.763421 O\n",
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"elements": [
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],
"chemical_system": "B-O-Pb",
"density": 5.455251562599096,
"density_atomic": 0.08056947862307315,
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"formula_full": "B33 Pb18 O81",
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"updated_at": "2021-11-28T01:37:14.221000Z",
"spacegroup": 145
},
{
"id": "mp-600156",
"created_at": "2022-09-04T14:39:40.888907Z",
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"updated_at": "2021-11-28T01:34:31.448000Z",
"spacegroup": 58
}
]
}