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            "structure_string": "Mn2 P4 H72 C24 N12 Cl4 O4\n1.0\n4.173486 11.955883 0.000000\n-4.173486 11.955883 0.000000\n0.000000 9.796676 12.744268\nMn P H C N Cl O\n2 4 72 24 12 4 4\ndirect\n0.699443 0.300557 0.750000 Mn\n0.300557 0.699443 0.250000 Mn\n0.336084 0.462926 0.955848 P\n0.537074 0.663916 0.544152 P\n0.663916 0.537074 0.044152 P\n0.462926 0.336084 0.455848 P\n0.212135 0.849858 0.916887 H\n0.150142 0.787865 0.583113 H\n0.787865 0.150142 0.083113 H\n0.849858 0.212135 0.416887 H\n0.415182 0.628358 0.932835 H\n0.371642 0.584818 0.567165 H\n0.584818 0.371642 0.067165 H\n0.628358 0.415182 0.432835 H\n0.242944 0.710963 0.045751 H\n0.289037 0.757056 0.454249 H\n0.757056 0.289037 0.954249 H\n0.710963 0.242944 0.545751 H\n0.960694 0.787544 0.075440 H\n0.212456 0.039306 0.424560 H\n0.039306 0.212456 0.924560 H\n0.787544 0.960694 0.575440 H\n0.966174 0.756974 0.976523 H\n0.243026 0.033826 0.523477 H\n0.033826 0.243026 0.023477 H\n0.756974 0.966174 0.476523 H\n0.962115 0.919843 0.944458 H\n0.080157 0.037885 0.555542 H\n0.037885 0.080157 0.055542 H\n0.919843 0.962115 0.444458 H\n0.298236 0.501916 0.759794 H\n0.498084 0.701764 0.740206 H\n0.701764 0.498084 0.240206 H\n0.501916 0.298236 0.259794 H\n0.171282 0.692599 0.795294 H\n0.307401 0.828718 0.704706 H\n0.828718 0.307401 0.204706 H\n0.692599 0.171282 0.295294 H\n0.067850 0.630378 0.820123 H\n0.369622 0.932150 0.679877 H\n0.932150 0.369622 0.179877 H\n0.630378 0.067850 0.320123 H\n0.140067 0.361946 0.952302 H\n0.638054 0.859933 0.547698 H\n0.859933 0.638054 0.047698 H\n0.361946 0.140067 0.452302 H\n0.260952 0.251584 0.039785 H\n0.748416 0.739048 0.460215 H\n0.739048 0.748416 0.960215 H\n0.251584 0.260952 0.539785 H\n0.373193 0.224953 0.908559 H\n0.775047 0.626807 0.591441 H\n0.626807 0.775047 0.091441 H\n0.224953 0.373193 0.408559 H\n0.181395 0.311389 0.193609 H\n0.688611 0.818605 0.306391 H\n0.818605 0.688611 0.806391 H\n0.311389 0.181395 0.693609 H\n0.128372 0.509437 0.157772 H\n0.490563 0.871628 0.342228 H\n0.871628 0.490563 0.842228 H\n0.509437 0.128372 0.657772 H\n0.286475 0.314552 0.231614 H\n0.685448 0.713525 0.268386 H\n0.713525 0.685448 0.768386 H\n0.314552 0.286475 0.731614 H\n0.587858 0.089227 0.140591 H\n0.910773 0.412142 0.359409 H\n0.412142 0.910773 0.859409 H\n0.089227 0.587858 0.640591 H\n0.627439 0.112922 0.007311 H\n0.887078 0.372561 0.492689 H\n0.372561 0.887078 0.992689 H\n0.112922 0.627439 0.507311 H\n0.498046 0.059686 0.109881 H\n0.940314 0.501954 0.390119 H\n0.501954 0.940314 0.890119 H\n0.059686 0.498046 0.609881 H\n0.273134 0.714970 0.965047 C\n0.285030 0.726866 0.534953 C\n0.726866 0.285030 0.034953 C\n0.714970 0.273134 0.465047 C\n0.013094 0.787392 0.991813 C\n0.212608 0.986906 0.508187 C\n0.986906 0.212608 0.008187 C\n0.787392 0.013094 0.491813 C\n0.189216 0.579866 0.818796 C\n0.420134 0.810784 0.681204 C\n0.810784 0.420134 0.181204 C\n0.579866 0.189216 0.318796 C\n0.252654 0.318930 0.957760 C\n0.681070 0.747346 0.542240 C\n0.747346 0.681070 0.042240 C\n0.318930 0.252654 0.457760 C\n0.235000 0.367051 0.168205 C\n0.632949 0.765000 0.331795 C\n0.765000 0.632949 0.831795 C\n0.367051 0.235000 0.668205 C\n0.530157 0.136171 0.082805 C\n0.863829 0.469843 0.417195 C\n0.469843 0.863829 0.917195 C\n0.136171 0.530157 0.582805 C\n0.204081 0.664138 0.961752 N\n0.335862 0.795919 0.538248 N\n0.795919 0.335862 0.038248 N\n0.664138 0.204081 0.461752 N\n0.223717 0.473809 0.923529 N\n0.526191 0.776283 0.576471 N\n0.776283 0.526191 0.076471 N\n0.473809 0.223717 0.423529 N\n0.374372 0.323269 0.072215 N\n0.676731 0.625628 0.427785 N\n0.625628 0.676731 0.927785 N\n0.323269 0.374372 0.572215 N\n0.934759 0.254271 0.728135 Cl\n0.745729 0.065241 0.771865 Cl\n0.065241 0.745729 0.271865 Cl\n0.254271 0.934759 0.228135 Cl\n0.510696 0.404182 0.879988 O\n0.595818 0.489304 0.620012 O\n0.489304 0.595818 0.120012 O\n0.404182 0.510696 0.379988 O\n",
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            "density_atomic": 0.09592555529561156,
            "volume": 1271.8195857614317,
            "volume_molar": 6.277931612114946,
            "formula_full": "Mn2 P4 H72 C24 N12 Cl4 O4",
            "formula_reduced": "MnP2H36C12N6(ClO)2",
            "formula_anonymous": "AB2C2D2E6F12G36",
            "energy": -674.7051587999999,
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            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:31.748000Z",
            "spacegroup": 15
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        {
            "id": "mp-744190",
            "created_at": "2022-09-04T14:48:15.814801Z",
            "structure_string": "K4 Mo4 H24 C8 N2 O6 F18\n1.0\n6.418058 -10.648843 0.000000\n6.418058 10.648843 0.000000\n0.000000 0.000000 6.476062\nK Mo H C N O F\n4 4 24 8 2 6 18\ndirect\n0.282272 0.782272 0.070450 K\n0.782272 0.282272 0.929550 K\n0.997813 0.497813 0.415858 K\n0.497813 0.997813 0.584142 K\n0.148109 0.855007 0.564946 Mo\n0.855007 0.148109 0.435054 Mo\n0.648109 0.355007 0.435054 Mo\n0.355007 0.648109 0.564946 Mo\n0.350286 0.382131 0.232203 H\n0.382131 0.350286 0.767797 H\n0.850286 0.882131 0.767797 H\n0.882131 0.850286 0.232203 H\n0.191427 0.341836 0.214213 H\n0.341836 0.191427 0.785787 H\n0.691427 0.841836 0.785787 H\n0.841836 0.691427 0.214213 H\n0.293952 0.437200 0.022468 H\n0.437200 0.293952 0.977532 H\n0.793952 0.937200 0.977532 H\n0.937200 0.793952 0.022468 H\n0.142811 0.124576 0.234533 H\n0.124576 0.142811 0.765467 H\n0.642811 0.624576 0.765467 H\n0.624576 0.642811 0.234533 H\n0.302090 0.164056 0.235363 H\n0.164056 0.302090 0.764637 H\n0.802090 0.664056 0.764637 H\n0.664056 0.802090 0.235363 H\n0.204692 0.064155 0.042279 H\n0.064155 0.204692 0.957721 H\n0.704692 0.564155 0.957721 H\n0.564155 0.704692 0.042279 H\n0.273911 0.360846 0.127026 C\n0.360846 0.273911 0.872974 C\n0.773911 0.860846 0.872974 C\n0.860846 0.773911 0.127026 C\n0.222325 0.143046 0.138977 C\n0.143046 0.222325 0.861023 C\n0.722325 0.643046 0.861023 C\n0.643046 0.722325 0.138977 C\n0.250182 0.250182 0.000000 N\n0.750182 0.750182 0.000000 N\n0.065069 0.932693 0.553840 O\n0.932693 0.065069 0.446160 O\n0.565069 0.432693 0.446160 O\n0.432693 0.565069 0.553840 O\n0.012692 0.512692 0.968765 O\n0.512692 0.012692 0.031235 O\n0.258570 0.945856 0.797872 F\n0.945856 0.258570 0.202128 F\n0.758570 0.445856 0.202128 F\n0.445856 0.758570 0.797872 F\n0.044196 0.725751 0.758093 F\n0.725751 0.044196 0.241907 F\n0.544196 0.225751 0.241907 F\n0.225751 0.544196 0.758093 F\n0.076021 0.739356 0.331708 F\n0.739356 0.076021 0.668292 F\n0.576021 0.239356 0.668292 F\n0.239356 0.576021 0.331708 F\n0.284127 0.953290 0.374271 F\n0.953290 0.284127 0.625729 F\n0.784127 0.453290 0.625729 F\n0.453290 0.784127 0.374271 F\n0.258457 0.758457 0.592335 F\n0.758457 0.258457 0.407665 F\n",
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            "elements": [
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            "density": 2.1129961252850578,
            "density_atomic": 0.07455845162889309,
            "volume": 885.2115160399,
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            "formula_full": "K4 Mo4 H24 C8 N2 O6 F18",
            "formula_reduced": "K2Mo2H12C4N(OF3)3",
            "formula_anonymous": "AB2C2D3E4F9G12",
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            "energy_uncorrected": -345.25527718,
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            "spacegroup": 39
        },
        {
            "id": "mp-1210325",
            "created_at": "2022-09-04T14:44:22.858170Z",
            "structure_string": "Na8 Zr4 Ti2 Mn2 Si8 O32 F4\n1.0\n7.192017 0.000000 0.000000\n0.000000 5.663980 0.000000\n0.000000 4.145941 18.265541\nNa Zr Ti Mn Si O F\n8 4 2 2 8 32 4\ndirect\n0.653396 0.000000 0.750000 Na\n0.346604 0.000000 0.250000 Na\n0.886366 0.703165 0.929057 Na\n0.113634 0.296835 0.070943 Na\n0.886366 0.296835 0.570943 Na\n0.113634 0.703165 0.429057 Na\n0.889497 0.500000 0.750000 Na\n0.110503 0.500000 0.250000 Na\n0.378419 0.697347 0.924728 Zr\n0.621581 0.302653 0.075272 Zr\n0.378419 0.302653 0.575272 Zr\n0.621581 0.697347 0.424728 Zr\n0.392473 0.500000 0.750000 Ti\n0.607527 0.500000 0.250000 Ti\n0.152877 0.000000 0.750000 Mn\n0.847123 0.000000 0.250000 Mn\n0.658469 0.778934 0.604396 Si\n0.341531 0.221066 0.395604 Si\n0.658469 0.221066 0.895604 Si\n0.341531 0.778934 0.104396 Si\n0.886224 0.778343 0.105327 Si\n0.113776 0.221657 0.894673 Si\n0.886224 0.221657 0.394673 Si\n0.113776 0.778343 0.605327 Si\n0.593155 0.597713 0.550986 O\n0.406845 0.402287 0.449014 O\n0.593155 0.402287 0.949014 O\n0.406845 0.597713 0.050986 O\n0.173939 0.943433 0.932717 O\n0.826061 0.056567 0.067283 O\n0.173939 0.056567 0.567283 O\n0.826061 0.943433 0.432717 O\n0.595437 0.940818 0.922734 O\n0.404563 0.059182 0.077266 O\n0.595437 0.059182 0.577266 O\n0.404563 0.940818 0.422734 O\n0.824080 0.580417 0.058823 O\n0.175920 0.419583 0.941177 O\n0.824080 0.419583 0.441177 O\n0.175920 0.580417 0.558823 O\n0.372317 0.731433 0.814135 O\n0.627683 0.268567 0.185865 O\n0.372317 0.268567 0.685865 O\n0.627683 0.731433 0.314135 O\n0.885420 0.764491 0.610390 O\n0.114580 0.235509 0.389610 O\n0.885420 0.235509 0.889610 O\n0.114580 0.764491 0.110390 O\n0.584575 0.676395 0.688474 O\n0.415425 0.323605 0.311526 O\n0.584575 0.323605 0.811526 O\n0.415425 0.676395 0.188474 O\n0.810308 0.712900 0.190390 O\n0.189692 0.287100 0.809610 O\n0.810308 0.287100 0.309610 O\n0.189692 0.712900 0.690390 O\n0.920971 0.804045 0.807100 F\n0.079029 0.195955 0.192900 F\n0.920971 0.195955 0.692900 F\n0.079029 0.804045 0.307100 F\n",
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            "volume": 744.054857649792,
            "volume_molar": 7.468005143214683,
            "formula_full": "Na8 Zr4 Ti2 Mn2 Si8 O32 F4",
            "formula_reduced": "Na4Zr2TiMnSi4(O8F)2",
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            "energy": -479.59672292,
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            "updated_at": "2021-11-28T01:36:41.340000Z",
            "spacegroup": 13
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        {
            "id": "mp-1201753",
            "created_at": "2022-09-04T14:39:27.014562Z",
            "structure_string": "Zn2 Co2 H44 C10 N20 Cl8 O12\n1.0\n7.832440 0.000000 0.000000\n-2.266310 12.093328 0.000000\n-3.243722 -5.007650 12.585479\nZn Co H C N Cl O\n2 2 44 10 20 8 12\ndirect\n0.952659 0.717593 0.298528 Zn\n0.047341 0.282407 0.701472 Zn\n0.460355 0.767068 0.744662 Co\n0.539645 0.232932 0.255338 Co\n0.445079 0.631668 0.060331 H\n0.554921 0.368332 0.939669 H\n0.280709 0.547598 0.936740 H\n0.719291 0.452402 0.063260 H\n0.665751 0.840967 0.974099 H\n0.334249 0.159033 0.025901 H\n0.665425 0.793570 0.081680 H\n0.334575 0.206430 0.918320 H\n0.023780 0.692320 0.761974 H\n0.976220 0.307680 0.238026 H\n0.979358 0.552543 0.771665 H\n0.020642 0.447457 0.228335 H\n0.704129 0.463433 0.778857 H\n0.295871 0.536567 0.221143 H\n0.524190 0.529396 0.766746 H\n0.475810 0.470604 0.233254 H\n0.648278 0.004768 0.732981 H\n0.351722 0.995232 0.267019 H\n0.765658 0.151778 0.819887 H\n0.234342 0.848222 0.180113 H\n0.724565 0.090063 0.047490 H\n0.275435 0.909937 0.952510 H\n0.799588 0.200169 0.003084 H\n0.200412 0.799831 0.996916 H\n0.385806 0.854682 0.443168 H\n0.614194 0.145318 0.556832 H\n0.537481 0.784927 0.390538 H\n0.462519 0.215073 0.609462 H\n0.717425 0.724836 0.621298 H\n0.282575 0.275164 0.378702 H\n0.727134 0.704038 0.491663 H\n0.272866 0.295962 0.508337 H\n0.300712 0.907879 0.623407 H\n0.699288 0.092121 0.376593 H\n0.147791 0.998159 0.629325 H\n0.852209 0.001841 0.370675 H\n0.985357 0.911380 0.814619 H\n0.014643 0.088620 0.185381 H\n0.975665 0.001770 0.741621 H\n0.024335 0.998230 0.258379 H\n0.219079 0.624073 0.555768 H\n0.780921 0.375927 0.444232 H\n0.228076 0.544761 0.624449 H\n0.771924 0.455239 0.375551 H\n0.464813 0.691404 0.939587 C\n0.535187 0.308596 0.060413 C\n0.762286 0.624739 0.761324 C\n0.237714 0.375261 0.238676 C\n0.691220 0.030641 0.888983 C\n0.308780 0.969359 0.111017 C\n0.553364 0.800030 0.544373 C\n0.446636 0.199970 0.455627 C\n0.164273 0.906920 0.730491 C\n0.835727 0.093080 0.269509 C\n0.380973 0.623341 0.984659 N\n0.619027 0.376659 0.015341 N\n0.617452 0.779266 0.003151 N\n0.382548 0.220734 0.996849 N\n0.939154 0.626874 0.773045 N\n0.060846 0.373126 0.226955 N\n0.651371 0.528005 0.762745 N\n0.348629 0.471995 0.237255 N\n0.708130 0.065691 0.808508 N\n0.291870 0.934309 0.191492 N\n0.764106 0.111907 0.989840 N\n0.235894 0.888093 0.010160 N\n0.490785 0.816854 0.453203 N\n0.509215 0.183146 0.546797 N\n0.681887 0.742044 0.553177 N\n0.318113 0.257956 0.446823 N\n0.209868 0.943076 0.656596 N\n0.790132 0.056924 0.343404 N\n0.050122 0.957841 0.778420 N\n0.949878 0.042159 0.221580 N\n0.118095 0.911778 0.389421 Cl\n0.881905 0.088222 0.610579 Cl\n0.974808 0.619474 0.415865 Cl\n0.025192 0.380526 0.584135 Cl\n0.651371 0.710850 0.233571 Cl\n0.348629 0.289150 0.766429 Cl\n0.061958 0.631205 0.164594 Cl\n0.938042 0.368795 0.835406 Cl\n0.397140 0.672527 0.841588 O\n0.602860 0.327473 0.158412 O\n0.706575 0.712510 0.748895 O\n0.293425 0.287490 0.251105 O\n0.616379 0.923209 0.874016 O\n0.383621 0.076791 0.125984 O\n0.493311 0.841255 0.623083 O\n0.506689 0.158745 0.376917 O\n0.227649 0.829718 0.760110 O\n0.772351 0.170282 0.239890 O\n0.301160 0.613110 0.615002 O\n0.698840 0.386890 0.384998 O\n",
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            "formula_full": "Zn2 Co2 H44 C10 N20 Cl8 O12",
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            "structure_string": "Zn2 Cr2 H56 C12 N24 Cl10 O16\n1.0\n10.737672 0.000000 0.000000\n-3.512817 10.431430 0.000000\n-2.703693 -3.737585 12.591787\nZn Cr H C N Cl O\n2 2 56 12 24 10 16\ndirect\n0.406524 0.698142 0.669578 Zn\n0.593476 0.301858 0.330422 Zn\n0.960059 0.957298 0.237903 Cr\n0.039941 0.042702 0.762097 Cr\n0.869481 0.290861 0.164160 H\n0.130519 0.709139 0.835840 H\n0.022540 0.393196 0.145668 H\n0.977460 0.606804 0.854332 H\n0.217478 0.323534 0.182103 H\n0.782522 0.676466 0.817897 H\n0.179084 0.156980 0.186808 H\n0.820916 0.843020 0.813192 H\n0.523624 0.833651 0.349921 H\n0.476376 0.166349 0.650079 H\n0.619592 0.002280 0.366023 H\n0.380408 0.997720 0.633977 H\n0.756497 0.713595 0.250232 H\n0.243503 0.286405 0.749768 H\n0.598287 0.667701 0.275473 H\n0.401713 0.332299 0.724527 H\n0.671955 0.617081 0.957677 H\n0.328045 0.382919 0.042323 H\n0.549408 0.683629 0.914897 H\n0.450592 0.316371 0.085103 H\n0.730881 0.001334 0.103642 H\n0.269119 0.998666 0.896358 H\n0.582639 0.901992 0.998078 H\n0.417361 0.098008 0.001922 H\n0.958380 0.726095 0.081684 H\n0.041620 0.273905 0.918316 H\n0.089434 0.662010 0.075505 H\n0.910566 0.337990 0.924495 H\n0.315955 0.816152 0.124740 H\n0.684045 0.183848 0.875260 H\n0.352991 0.977821 0.202096 H\n0.647009 0.022179 0.797904 H\n0.093045 0.606557 0.376228 H\n0.906955 0.393443 0.623772 H\n0.937856 0.575392 0.279655 H\n0.062144 0.424608 0.720345 H\n0.270804 0.823991 0.402818 H\n0.729196 0.176009 0.597182 H\n0.214550 0.955877 0.392929 H\n0.785450 0.044123 0.607071 H\n0.329791 0.259715 0.456340 H\n0.670209 0.740285 0.543660 H\n0.274005 0.381282 0.518032 H\n0.725995 0.618718 0.481968 H\n0.030093 0.332493 0.468374 H\n0.969907 0.667507 0.531626 H\n0.920850 0.167959 0.394464 H\n0.079150 0.832041 0.605536 H\n0.377243 0.625042 0.374111 H\n0.622757 0.374958 0.625889 H\n0.313829 0.631830 0.261069 H\n0.686171 0.368170 0.738931 H\n0.730197 0.407299 0.153241 H\n0.269803 0.592701 0.846759 H\n0.776898 0.494951 0.079130 H\n0.223102 0.505049 0.920870 H\n0.017783 0.215462 0.175996 C\n0.982217 0.784538 0.824004 C\n0.702407 0.870431 0.305580 C\n0.297593 0.129569 0.694420 C\n0.712919 0.808817 0.043322 C\n0.287081 0.191183 0.956678 C\n0.150658 0.865481 0.136994 C\n0.849342 0.134519 0.863006 C\n0.064421 0.769945 0.337663 C\n0.935579 0.230055 0.662337 C\n0.123695 0.201752 0.422973 C\n0.876305 0.798248 0.577027 C\n0.970006 0.312885 0.167730 N\n0.029994 0.687115 0.832270 N\n0.148508 0.234694 0.181051 N\n0.851492 0.765306 0.818949 N\n0.610243 0.905163 0.346132 N\n0.389757 0.094837 0.653868 N\n0.678822 0.740533 0.266557 N\n0.321178 0.259467 0.733443 N\n0.635608 0.692530 0.968569 N\n0.364392 0.307470 0.031431 N\n0.668098 0.910010 0.052315 N\n0.331902 0.089990 0.947685 N\n0.059228 0.741871 0.089153 N\n0.940772 0.258129 0.910847 N\n0.285027 0.893335 0.145173 N\n0.714973 0.106665 0.854827 N\n0.031036 0.639750 0.330599 N\n0.968964 0.360250 0.669401 N\n0.192490 0.857718 0.389073 N\n0.807510 0.142282 0.610927 N\n0.252671 0.286155 0.474808 N\n0.747329 0.713845 0.525192 N\n0.017267 0.237775 0.430228 N\n0.982733 0.762225 0.569772 N\n0.783396 0.468795 0.907889 Cl\n0.216604 0.531205 0.092111 Cl\n0.192946 0.577528 0.554501 Cl\n0.807054 0.422472 0.445499 Cl\n0.516482 0.554211 0.691222 Cl\n0.483518 0.445789 0.308778 Cl\n0.523967 0.859246 0.602880 Cl\n0.476033 0.140754 0.397120 Cl\n0.389916 0.804419 0.833672 Cl\n0.610084 0.195581 0.166328 Cl\n0.933465 0.104252 0.180004 O\n0.066535 0.895748 0.819996 O\n0.810356 0.964763 0.304062 O\n0.189644 0.035237 0.695938 O\n0.826199 0.817654 0.104572 O\n0.173801 0.182346 0.895428 O\n0.115211 0.962981 0.173356 O\n0.884789 0.037019 0.826644 O\n0.968610 0.805953 0.294720 O\n0.031390 0.194047 0.705280 O\n0.106149 0.084379 0.367528 O\n0.893851 0.915621 0.632472 O\n0.355682 0.686243 0.336333 O\n0.644318 0.313757 0.663667 O\n0.785662 0.497922 0.154319 O\n0.214338 0.502078 0.845681 O\n",
            "nsites": 122,
            "nelements": 7,
            "elements": [
                "Zn",
                "Cr",
                "H",
                "C",
                "N",
                "Cl",
                "O"
            ],
            "chemical_system": "C-Cl-Cr-H-N-O-Zn",
            "density": 1.6271816576737763,
            "density_atomic": 0.08650047262156124,
            "volume": 1410.3969181041225,
            "volume_molar": 6.961974400240342,
            "formula_full": "Zn2 Cr2 H56 C12 N24 Cl10 O16",
            "formula_reduced": "ZnCrH28C6N12Cl5O8",
            "formula_anonymous": "ABC5D6E8F12G28",
            "energy": -726.47793671,
            "energy_per_atom": -5.954737186147541,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -696.68393671,
            "band_gap": 3.4335,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 2.0148159,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:25.368000Z",
            "spacegroup": 2
        },
        {
            "id": "mp-1198643",
            "created_at": "2022-09-04T14:46:38.264274Z",
            "structure_string": "Zn4 H48 C12 Se4 S12 N24 O16\n1.0\n7.985730 0.000000 0.000000\n0.000000 11.453378 0.000000\n0.000000 0.000000 15.984837\nZn H C Se S N O\n4 48 12 4 12 24 16\ndirect\n0.661095 0.937380 0.921226 Zn\n0.338905 0.062620 0.421226 Zn\n0.661095 0.562620 0.421226 Zn\n0.338905 0.437380 0.921226 Zn\n0.306048 0.149669 0.721452 H\n0.693952 0.850331 0.221452 H\n0.306048 0.350331 0.221452 H\n0.693952 0.649669 0.721452 H\n0.163706 0.034801 0.708983 H\n0.836294 0.965199 0.208983 H\n0.163706 0.465199 0.208983 H\n0.836294 0.534801 0.708983 H\n0.203056 0.857700 0.778260 H\n0.796944 0.142300 0.278260 H\n0.203056 0.642300 0.278260 H\n0.796944 0.357700 0.778260 H\n0.351211 0.853944 0.860975 H\n0.648789 0.146056 0.360975 H\n0.351211 0.646056 0.360975 H\n0.648789 0.353944 0.860975 H\n0.920801 0.087226 0.856732 H\n0.079199 0.912774 0.356732 H\n0.920801 0.412774 0.356732 H\n0.079199 0.587226 0.856732 H\n0.024808 0.218661 0.876262 H\n0.975192 0.781339 0.376262 H\n0.024808 0.281339 0.376262 H\n0.975192 0.718661 0.876262 H\n0.977174 0.215349 0.095793 H\n0.022826 0.784651 0.595793 H\n0.977174 0.284651 0.595793 H\n0.022826 0.715349 0.095793 H\n0.061406 0.288779 0.009691 H\n0.938594 0.711221 0.509691 H\n0.061406 0.211221 0.509691 H\n0.938594 0.788779 0.009691 H\n0.281403 0.880544 0.183884 H\n0.718597 0.119456 0.683884 H\n0.281403 0.619456 0.683884 H\n0.718597 0.380544 0.183884 H\n0.398230 0.755142 0.155637 H\n0.601770 0.244858 0.655637 H\n0.398230 0.744858 0.655637 H\n0.601770 0.255142 0.155637 H\n0.400750 0.035276 0.002271 H\n0.599250 0.964724 0.502271 H\n0.400750 0.464724 0.502271 H\n0.599250 0.535276 0.002271 H\n0.314814 0.048647 0.101727 H\n0.685186 0.951353 0.601727 H\n0.314814 0.451353 0.601727 H\n0.685186 0.548647 0.101727 H\n0.349132 0.005357 0.794757 C\n0.650868 0.994643 0.294757 C\n0.349132 0.494643 0.294757 C\n0.650868 0.505357 0.794757 C\n0.932756 0.138223 0.980892 C\n0.067244 0.861777 0.480892 C\n0.932756 0.361777 0.480892 C\n0.067244 0.638223 0.980892 C\n0.398981 0.884624 0.069296 C\n0.601019 0.115376 0.569296 C\n0.398981 0.615376 0.569296 C\n0.601019 0.384624 0.069296 C\n0.851311 0.873533 0.747351 Se\n0.148689 0.126467 0.247351 Se\n0.851311 0.626467 0.247351 Se\n0.148689 0.373533 0.747351 Se\n0.503258 0.077181 0.851347 S\n0.496742 0.922819 0.351347 S\n0.503258 0.422819 0.351347 S\n0.496742 0.577181 0.851347 S\n0.827475 0.021578 0.025182 S\n0.172525 0.978422 0.525182 S\n0.827475 0.478422 0.525182 S\n0.172525 0.521578 0.025182 S\n0.509576 0.799505 0.998376 S\n0.490424 0.200495 0.498376 S\n0.509576 0.700495 0.498376 S\n0.490424 0.299505 0.998376 S\n0.273390 0.065124 0.733868 N\n0.726610 0.934876 0.233868 N\n0.273390 0.434876 0.233868 N\n0.726610 0.565124 0.733868 N\n0.301776 0.895949 0.810547 N\n0.698224 0.104051 0.310547 N\n0.301776 0.604051 0.310547 N\n0.698224 0.395949 0.810547 N\n0.954075 0.150418 0.898737 N\n0.045925 0.849582 0.398737 N\n0.954075 0.349582 0.398737 N\n0.045925 0.650418 0.898737 N\n0.995168 0.219702 0.032422 N\n0.004832 0.780298 0.532422 N\n0.995168 0.280298 0.532422 N\n0.004832 0.719702 0.032422 N\n0.351946 0.834800 0.140975 N\n0.648054 0.165200 0.640975 N\n0.351946 0.665200 0.640975 N\n0.648054 0.334800 0.140975 N\n0.354111 0.994900 0.053960 N\n0.645889 0.005100 0.553960 N\n0.354111 0.505100 0.553960 N\n0.645889 0.494900 0.053960 N\n0.820075 0.841008 0.851185 O\n0.179925 0.158992 0.351185 O\n0.820075 0.658992 0.351185 O\n0.179925 0.341008 0.851185 O\n0.024682 0.800995 0.719627 O\n0.975318 0.199005 0.219627 O\n0.024682 0.699005 0.219627 O\n0.975318 0.300995 0.719627 O\n0.881896 0.017370 0.739085 O\n0.118104 0.982630 0.239085 O\n0.881896 0.482630 0.239085 O\n0.118104 0.517370 0.739085 O\n0.687086 0.828813 0.691671 O\n0.312914 0.171187 0.191671 O\n0.687086 0.671187 0.191671 O\n0.312914 0.328813 0.691671 O\n",
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            "elements": [
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                "H",
                "C",
                "Se",
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                "N",
                "O"
            ],
            "chemical_system": "C-H-N-O-S-Se-Zn",
            "density": 1.9841059995861605,
            "density_atomic": 0.08207763183855173,
            "volume": 1462.030486406361,
            "volume_molar": 7.337127820458644,
            "formula_full": "Zn4 H48 C12 Se4 S12 N24 O16",
            "formula_reduced": "ZnH12C3SeS3(N3O2)2",
            "formula_anonymous": "ABC3D3E4F6G12",
            "energy": -694.70576109,
            "energy_per_atom": -5.78921467575,
            "energy_above_hull": null,
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            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -669.01376109,
            "band_gap": 3.4695,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.000984,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:40.405000Z",
            "spacegroup": 29
        },
        {
            "id": "mp-643446",
            "created_at": "2022-09-04T14:43:05.820407Z",
            "structure_string": "Ca2 Al1 H8 S2 Cl1 O12 F2\n1.0\n-3.481339 3.481339 6.610371\n3.481339 -3.481339 6.610371\n3.481339 3.481339 -6.610371\nCa Al H S Cl O F\n2 1 8 2 1 12 2\ndirect\n0.302368 0.302368 0.000000 Ca\n0.697632 0.697632 0.000000 Ca\n0.000000 0.000000 0.000000 Al\n0.035780 0.600907 0.759438 H\n0.841469 0.276341 0.240562 H\n0.276341 0.035780 0.434872 H\n0.600907 0.841469 0.565128 H\n0.964220 0.399093 0.240562 H\n0.158531 0.723659 0.759438 H\n0.723659 0.964220 0.565128 H\n0.399093 0.158531 0.434872 H\n0.750000 0.250000 0.500000 S\n0.250000 0.750000 0.500000 S\n0.500000 0.500000 0.000000 Cl\n0.654441 0.252691 0.274977 O\n0.977714 0.379464 0.725023 O\n0.379464 0.654441 0.401750 O\n0.252691 0.977714 0.598250 O\n0.345559 0.747309 0.725023 O\n0.022286 0.620536 0.274977 O\n0.620536 0.345559 0.598250 O\n0.747309 0.022286 0.401750 O\n0.043796 0.724979 0.768776 O\n0.956204 0.275021 0.231224 O\n0.275021 0.043796 0.318817 O\n0.724979 0.956204 0.681183 O\n0.134219 0.134219 0.000000 F\n0.865781 0.865781 0.000000 F\n",
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            "elements": [
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                "H",
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                "Cl",
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                "F"
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            "chemical_system": "Al-Ca-Cl-F-H-O-S",
            "density": 2.304675079300875,
            "density_atomic": 0.08737346818307906,
            "volume": 320.4634150647409,
            "volume_molar": 6.8924135498220505,
            "formula_full": "Ca2 Al1 H8 S2 Cl1 O12 F2",
            "formula_reduced": "Ca2AlH8S2Cl(O6F)2",
            "formula_anonymous": "ABC2D2E2F8G12",
            "energy": -169.08713649,
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            "updated_at": "2021-11-28T01:35:58.091000Z",
            "spacegroup": 87
        }
    ]
}