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{
"id": "mp-1203605",
"created_at": "2022-09-04T14:39:28.331371Z",
"structure_string": "Hf42 Re50\n1.0\n7.996651 -12.899453 0.000000\n7.996651 12.899453 0.000000\n-12.811546 0.000000 8.136743\nHf Re\n42 50\ndirect\n0.054634 0.445366 0.750000 Hf\n0.750000 0.054634 0.445366 Hf\n0.445366 0.750000 0.054634 Hf\n0.250000 0.945366 0.554634 Hf\n0.554634 0.250000 0.945366 Hf\n0.945366 0.554634 0.250000 Hf\n0.953221 0.726956 0.186119 Hf\n0.186119 0.953221 0.726956 Hf\n0.726956 0.186119 0.953221 Hf\n0.686119 0.226956 0.453221 Hf\n0.453221 0.686119 0.226956 Hf\n0.226956 0.453221 0.686119 Hf\n0.046779 0.273044 0.813881 Hf\n0.813881 0.046779 0.273044 Hf\n0.273044 0.813881 0.046779 Hf\n0.313881 0.773044 0.546779 Hf\n0.546779 0.313881 0.773044 Hf\n0.773044 0.546779 0.313881 Hf\n0.818644 0.934014 0.049506 Hf\n0.049506 0.818644 0.934014 Hf\n0.934014 0.049506 0.818644 Hf\n0.549506 0.434014 0.318644 Hf\n0.318644 0.549506 0.434014 Hf\n0.434014 0.318644 0.549506 Hf\n0.181356 0.065986 0.950494 Hf\n0.950494 0.181356 0.065986 Hf\n0.065986 0.950494 0.181356 Hf\n0.450494 0.565986 0.681356 Hf\n0.681356 0.450494 0.565986 Hf\n0.565986 0.681356 0.450494 Hf\n0.439166 0.957417 0.862103 Hf\n0.862103 0.439166 0.957417 Hf\n0.957417 0.862103 0.439166 Hf\n0.362103 0.457417 0.939166 Hf\n0.939166 0.362103 0.457417 Hf\n0.457417 0.939166 0.362103 Hf\n0.560834 0.042583 0.137897 Hf\n0.137897 0.560834 0.042583 Hf\n0.042583 0.137897 0.560834 Hf\n0.637897 0.542583 0.060834 Hf\n0.060834 0.637897 0.542583 Hf\n0.542583 0.060834 0.637897 Hf\n0.000000 0.000000 0.000000 Re\n0.500000 0.500000 0.500000 Re\n0.688629 0.811371 0.750000 Re\n0.750000 0.688629 0.811371 Re\n0.811371 0.750000 0.688629 Re\n0.250000 0.311371 0.188629 Re\n0.188629 0.250000 0.311371 Re\n0.311371 0.188629 0.250000 Re\n0.306262 0.193738 0.750000 Re\n0.750000 0.306262 0.193738 Re\n0.193738 0.750000 0.306262 Re\n0.250000 0.693738 0.806262 Re\n0.806262 0.250000 0.693738 Re\n0.693738 0.806262 0.250000 Re\n0.693631 0.631770 0.930068 Re\n0.930068 0.693631 0.631770 Re\n0.631770 0.930068 0.693631 Re\n0.430068 0.131770 0.193631 Re\n0.193631 0.430068 0.131770 Re\n0.131770 0.193631 0.430068 Re\n0.306369 0.368230 0.069932 Re\n0.069932 0.306369 0.368230 Re\n0.368230 0.069932 0.306369 Re\n0.569932 0.868230 0.806369 Re\n0.806369 0.569932 0.868230 Re\n0.868230 0.806369 0.569932 Re\n0.519436 0.811839 0.929466 Re\n0.929466 0.519436 0.811839 Re\n0.811839 0.929466 0.519436 Re\n0.429466 0.311839 0.019436 Re\n0.019436 0.429466 0.311839 Re\n0.311839 0.019436 0.429466 Re\n0.480564 0.188161 0.070534 Re\n0.070534 0.480564 0.188161 Re\n0.188161 0.070534 0.480564 Re\n0.570534 0.688161 0.980564 Re\n0.980564 0.570534 0.688161 Re\n0.688161 0.980564 0.570534 Re\n0.764563 0.119185 0.116389 Re\n0.116389 0.764563 0.119185 Re\n0.119185 0.116389 0.764563 Re\n0.616389 0.619185 0.264563 Re\n0.264563 0.616389 0.619185 Re\n0.619185 0.264563 0.616389 Re\n0.235437 0.880815 0.883611 Re\n0.883611 0.235437 0.880815 Re\n0.880815 0.883611 0.235437 Re\n0.383611 0.380815 0.735437 Re\n0.735437 0.383611 0.380815 Re\n0.380815 0.735437 0.383611 Re\n",
"nsites": 92,
"nelements": 2,
"elements": [
"Hf",
"Re"
],
"chemical_system": "Hf-Re",
"density": 16.625604966644488,
"density_atomic": 0.054805960811865756,
"volume": 1678.649523467191,
"volume_molar": 10.988112735898204,
"formula_full": "Hf42 Re50",
"formula_reduced": "Hf21Re25",
"formula_anonymous": "A21B25",
"energy": -1078.26563078,
"energy_per_atom": -11.720278595434783,
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"energy_uncorrected": -1078.26563078,
"band_gap": 0.0,
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"total_magnetization": 0.0151964,
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"updated_at": "2021-11-28T01:34:28.972000Z",
"spacegroup": 167
},
{
"id": "mp-1099661",
"created_at": "2022-09-04T14:46:57.477948Z",
"structure_string": "Sr28 Ca4 Mn12 Fe20 O80\n1.0\n0.019740 -0.012349 11.183617\n11.342171 0.005129 0.020658\n-5.674028 15.862299 -5.619250\nSr Ca Mn Fe O\n28 4 12 20 80\ndirect\n0.306995 0.059308 0.608093 Sr\n0.307342 0.559230 0.608225 Sr\n0.807224 0.059528 0.608236 Sr\n0.805615 0.563991 0.108755 Sr\n0.807121 0.559194 0.608453 Sr\n0.196572 0.436045 0.390135 Sr\n0.198977 0.441725 0.892758 Sr\n0.198062 0.938074 0.389416 Sr\n0.199146 0.941074 0.892764 Sr\n0.698282 0.438267 0.391649 Sr\n0.699491 0.441788 0.892518 Sr\n0.697900 0.939698 0.390237 Sr\n0.699820 0.940754 0.892935 Sr\n0.057189 0.295212 0.109914 Sr\n0.056819 0.298570 0.607862 Sr\n0.057430 0.799285 0.608433 Sr\n0.556641 0.295714 0.108928 Sr\n0.557283 0.298887 0.608078 Sr\n0.557220 0.799918 0.110128 Sr\n0.557174 0.799170 0.608100 Sr\n0.446138 0.199621 0.388530 Sr\n0.448539 0.200872 0.892452 Sr\n0.445324 0.700513 0.388371 Sr\n0.448933 0.701883 0.892683 Sr\n0.946958 0.198548 0.387784 Sr\n0.949641 0.200831 0.892768 Sr\n0.946578 0.703476 0.390551 Sr\n0.949624 0.702320 0.892981 Sr\n0.302598 0.062690 0.105220 Ca\n0.303527 0.564137 0.105366 Ca\n0.806303 0.062341 0.106351 Ca\n0.057337 0.790694 0.105725 Ca\n0.111296 0.097460 0.750800 Mn\n0.110883 0.597454 0.750727 Mn\n0.608272 0.094115 0.247955 Mn\n0.611163 0.096924 0.750579 Mn\n0.611254 0.597648 0.750702 Mn\n0.358959 0.401075 0.247741 Mn\n0.360964 0.403368 0.750640 Mn\n0.355158 0.903673 0.246287 Mn\n0.361367 0.903414 0.750710 Mn\n0.861311 0.403534 0.750773 Mn\n0.860762 0.902540 0.248123 Mn\n0.861552 0.903250 0.750850 Mn\n0.007319 0.001723 0.005070 Fe\n0.003591 0.000378 0.499241 Fe\n0.006035 0.501842 0.002537 Fe\n0.004083 0.499549 0.500006 Fe\n0.505695 0.001268 0.003437 Fe\n0.503187 0.000182 0.499370 Fe\n0.504494 0.501595 0.001888 Fe\n0.503405 0.500440 0.499712 Fe\n0.255153 0.251962 0.002888 Fe\n0.254250 0.249850 0.500176 Fe\n0.255393 0.752514 0.004070 Fe\n0.254090 0.750214 0.500157 Fe\n0.754663 0.249468 0.001068 Fe\n0.752932 0.249173 0.499170 Fe\n0.756708 0.753438 0.003813 Fe\n0.753874 0.750635 0.500431 Fe\n0.106365 0.084977 0.245929 Fe\n0.109205 0.589743 0.248922 Fe\n0.605491 0.590021 0.247870 Fe\n0.857579 0.407082 0.249233 Fe\n0.124820 0.122912 0.492703 O\n0.126561 0.121952 0.993979 O\n0.123584 0.621885 0.491709 O\n0.126175 0.624023 0.995771 O\n0.624342 0.122875 0.493710 O\n0.627038 0.122811 0.995483 O\n0.624514 0.622898 0.492401 O\n0.624715 0.622992 0.992694 O\n0.135973 0.383039 0.011861 O\n0.131613 0.376903 0.506298 O\n0.134791 0.880380 0.013449 O\n0.130953 0.876857 0.505610 O\n0.632417 0.377733 0.008972 O\n0.630780 0.377669 0.505955 O\n0.635166 0.880925 0.009172 O\n0.630345 0.876754 0.505256 O\n0.374117 0.121161 0.492732 O\n0.375507 0.121760 0.995531 O\n0.373969 0.621103 0.492412 O\n0.374727 0.621106 0.995636 O\n0.874776 0.121333 0.493565 O\n0.875292 0.119828 0.995322 O\n0.873808 0.620007 0.491421 O\n0.878435 0.623831 0.995996 O\n0.382032 0.384171 0.011337 O\n0.381375 0.378960 0.506112 O\n0.380630 0.883111 0.010021 O\n0.381538 0.879075 0.506348 O\n0.883150 0.380749 0.009650 O\n0.880724 0.378762 0.505525 O\n0.886394 0.883189 0.013416 O\n0.881641 0.879126 0.506756 O\n0.090511 0.096096 0.139550 O\n0.076131 0.085702 0.636319 O\n0.085812 0.602920 0.141708 O\n0.075172 0.585669 0.635806 O\n0.580347 0.085380 0.135693 O\n0.575525 0.085542 0.636201 O\n0.584770 0.596411 0.139900 O\n0.575482 0.585998 0.636008 O\n0.439295 0.416792 0.362517 O\n0.439140 0.413992 0.864825 O\n0.436223 0.917824 0.361910 O\n0.439747 0.914606 0.864731 O\n0.940055 0.404286 0.359401 O\n0.940407 0.414759 0.865195 O\n0.940058 0.916810 0.363559 O\n0.940155 0.913624 0.864806 O\n0.325535 0.290913 0.136766 O\n0.325981 0.300466 0.636206 O\n0.326136 0.790558 0.136087 O\n0.325307 0.800219 0.635883 O\n0.831057 0.286981 0.141679 O\n0.825742 0.301089 0.636367 O\n0.827728 0.797536 0.135710 O\n0.825592 0.800159 0.635921 O\n0.190923 0.198622 0.357099 O\n0.189899 0.200870 0.865116 O\n0.190947 0.703953 0.358828 O\n0.189050 0.700152 0.864860 O\n0.685489 0.198012 0.363034 O\n0.690261 0.199927 0.865061 O\n0.688233 0.703773 0.358045 O\n0.691189 0.700677 0.864526 O\n0.430915 0.059985 0.240996 O\n0.441707 0.062138 0.750476 O\n0.432131 0.556154 0.241424 O\n0.441975 0.562183 0.750710 O\n0.934060 0.060408 0.241940 O\n0.941783 0.062072 0.750567 O\n0.936272 0.559127 0.248588 O\n0.941750 0.562206 0.750683 O\n0.183347 0.436223 0.249448 O\n0.191703 0.438294 0.750327 O\n0.175176 0.926297 0.242218 O\n0.191921 0.938241 0.750631 O\n0.685464 0.437959 0.249744 O\n0.691824 0.438115 0.750383 O\n0.689957 0.938374 0.249992 O\n0.691960 0.938158 0.750472 O\n",
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"elements": [
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],
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"density": 4.680277331020561,
"density_atomic": 0.0715844567872741,
"volume": 2011.6098726280977,
"volume_molar": 8.41263736609172,
"formula_full": "Sr28 Ca4 Mn12 Fe20 O80",
"formula_reduced": "Sr7CaMn3(FeO4)5",
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"energy": -1078.3101438899998,
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"updated_at": "2021-11-28T01:37:46.717000Z",
"spacegroup": 1
},
{
"id": "mp-1194852",
"created_at": "2022-09-04T14:41:32.061862Z",
"structure_string": "Na8 Cd8 P24 H64 O80\n1.0\n-9.492976 0.000000 0.000000\n-0.000000 0.000000 -15.190080\n0.000000 -15.538320 0.000000\nNa Cd P H O\n8 8 24 64 80\ndirect\n0.944085 0.940813 0.348805 Na\n0.444085 0.059187 0.151195 Na\n0.055915 0.559187 0.848805 Na\n0.555915 0.440813 0.651195 Na\n0.055915 0.059187 0.651195 Na\n0.555915 0.940813 0.848805 Na\n0.944085 0.440813 0.151195 Na\n0.444085 0.559187 0.348805 Na\n0.052988 0.045557 0.157397 Cd\n0.552988 0.954443 0.342603 Cd\n0.947012 0.454443 0.657397 Cd\n0.447012 0.545557 0.842603 Cd\n0.947012 0.954443 0.842603 Cd\n0.447012 0.045557 0.657397 Cd\n0.052988 0.545557 0.342603 Cd\n0.552988 0.454443 0.157397 Cd\n0.264684 0.011770 0.466703 P\n0.764684 0.988230 0.033297 P\n0.735316 0.488230 0.966703 P\n0.235316 0.511770 0.533297 P\n0.735316 0.988230 0.533297 P\n0.235316 0.011770 0.966703 P\n0.264684 0.511770 0.033297 P\n0.764684 0.488230 0.466703 P\n0.759335 0.121524 0.273049 P\n0.259335 0.878476 0.226951 P\n0.240665 0.378476 0.773049 P\n0.740665 0.621524 0.726951 P\n0.240665 0.878476 0.726951 P\n0.740665 0.121524 0.773049 P\n0.759335 0.621524 0.226951 P\n0.259335 0.378476 0.273049 P\n0.033490 0.743864 0.466662 P\n0.533490 0.256136 0.033338 P\n0.966510 0.756136 0.966662 P\n0.466510 0.243864 0.533338 P\n0.966510 0.256136 0.533338 P\n0.466510 0.743864 0.966662 P\n0.033490 0.243864 0.033338 P\n0.533490 0.756136 0.466662 P\n0.246883 0.922159 0.446699 H\n0.746883 0.077841 0.053301 H\n0.753117 0.577841 0.946699 H\n0.253117 0.422159 0.553301 H\n0.753117 0.077841 0.553301 H\n0.253117 0.922159 0.946699 H\n0.246883 0.422159 0.053301 H\n0.746883 0.577841 0.446699 H\n0.758759 0.162502 0.354251 H\n0.258759 0.837498 0.145749 H\n0.241241 0.337498 0.854251 H\n0.741241 0.662502 0.645749 H\n0.241241 0.837498 0.645749 H\n0.741241 0.162502 0.854251 H\n0.758759 0.662502 0.145749 H\n0.258759 0.337498 0.354251 H\n0.181610 0.742440 0.459735 H\n0.681610 0.257560 0.040265 H\n0.818390 0.757560 0.959735 H\n0.318390 0.242440 0.540265 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{
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{
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{
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{
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{
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"created_at": "2022-09-04T14:44:01.212959Z",
"structure_string": "K8 Ca8 P24 H32 O88\n1.0\n12.826004 0.000000 0.000000\n0.000000 7.913730 0.000000\n0.000000 0.246473 20.560215\nK Ca P H O\n8 8 24 32 88\ndirect\n0.730640 0.986883 0.336661 K\n0.230640 0.013117 0.163339 K\n0.269360 0.013117 0.663339 K\n0.769360 0.986883 0.836661 K\n0.550497 0.736963 0.165654 K\n0.050497 0.263037 0.334346 K\n0.449503 0.263037 0.834346 K\n0.949503 0.736963 0.665654 K\n0.754471 0.508602 0.375549 Ca\n0.254471 0.491398 0.124451 Ca\n0.245529 0.491398 0.624451 Ca\n0.745529 0.508602 0.875549 Ca\n0.303692 0.000280 0.413089 Ca\n0.803692 0.999720 0.086911 Ca\n0.696308 0.999720 0.586911 Ca\n0.196308 0.000280 0.913089 Ca\n0.828441 0.685494 0.216845 P\n0.328441 0.314506 0.283155 P\n0.171559 0.314506 0.783155 P\n0.671559 0.685494 0.716845 P\n0.992244 0.668699 0.117115 P\n0.492244 0.331301 0.382885 P\n0.007756 0.331301 0.882885 P\n0.507756 0.668699 0.617115 P\n0.504249 0.700820 0.361419 P\n0.004249 0.299180 0.138581 P\n0.495751 0.299180 0.638581 P\n0.995751 0.700820 0.861419 P\n0.814340 0.316058 0.218242 P\n0.314340 0.683942 0.281758 P\n0.185660 0.683942 0.781758 P\n0.685660 0.316058 0.718242 P\n0.613795 0.831941 0.979121 P\n0.113795 0.168059 0.520879 P\n0.386205 0.168059 0.020879 P\n0.886205 0.831941 0.479121 P\n0.611139 0.211067 0.983111 P\n0.111139 0.788933 0.516889 P\n0.388861 0.788933 0.016889 P\n0.888861 0.211067 0.483111 P\n0.631897 0.087532 0.201953 H\n0.131897 0.912468 0.298047 H\n0.368103 0.912468 0.798047 H\n0.868103 0.087532 0.701953 H\n0.035658 0.868865 0.256182 H\n0.535658 0.131135 0.243818 H\n0.964342 0.131135 0.743818 H\n0.464342 0.868865 0.756182 H\n0.801448 0.413502 0.005645 H\n0.301448 0.586498 0.494355 H\n0.198552 0.586498 0.994355 H\n0.698552 0.413502 0.505645 H\n0.162447 0.398599 0.984673 H\n0.662447 0.601401 0.515327 H\n0.837553 0.601401 0.015327 H\n0.337553 0.398599 0.484673 H\n0.073864 0.049731 0.036330 H\n0.573864 0.950269 0.463670 H\n0.926136 0.950269 0.963670 H\n0.426136 0.049731 0.536330 H\n0.630890 0.122473 0.449916 H\n0.130890 0.877527 0.050084 H\n0.369110 0.877527 0.550084 H\n0.869110 0.122473 0.949916 H\n0.609095 0.353758 0.136726 H\n0.109095 0.646242 0.363274 H\n0.390905 0.646242 0.863274 H\n0.890905 0.353758 0.636726 H\n0.989077 0.627818 0.362193 H\n0.489077 0.372182 0.137807 H\n0.010923 0.372182 0.637807 H\n0.510923 0.627818 0.862193 H\n0.767181 0.818760 0.181067 O\n0.267181 0.181240 0.318933 O\n0.232819 0.181240 0.818933 O\n0.732819 0.818760 0.681067 O\n0.832771 0.685395 0.289469 O\n0.332771 0.314605 0.210531 O\n0.167229 0.314605 0.710531 O\n0.667229 0.685395 0.789469 O\n0.949586 0.687896 0.191684 O\n0.449586 0.312104 0.308316 O\n0.050414 0.312104 0.808316 O\n0.550414 0.687896 0.691684 O\n0.424505 0.231154 0.428832 O\n0.924505 0.768846 0.071168 O\n0.575495 0.768846 0.571168 O\n0.075495 0.231154 0.928832 O\n0.607448 0.297268 0.380367 O\n0.107448 0.702732 0.119633 O\n0.392552 0.702732 0.619633 O\n0.892552 0.297268 0.880367 O\n0.467403 0.528364 0.398226 O\n0.967403 0.471636 0.101774 O\n0.532597 0.471636 0.601774 O\n0.032597 0.528364 0.898226 O\n0.464952 0.846319 0.400743 O\n0.964952 0.153681 0.099257 O\n0.535048 0.153681 0.599257 O\n0.035048 0.846319 0.900743 O\n0.616978 0.690623 0.343551 O\n0.116978 0.309377 0.156449 O\n0.383022 0.309377 0.656449 O\n0.883022 0.690623 0.843551 O\n0.940278 0.307585 0.207340 O\n0.440278 0.692415 0.292660 O\n0.059722 0.692415 0.792660 O\n0.559722 0.307585 0.707340 O\n0.760598 0.193217 0.174315 O\n0.260598 0.806783 0.325685 O\n0.239402 0.806783 0.825685 O\n0.739402 0.193217 0.674315 O\n0.298449 0.695453 0.209685 O\n0.798449 0.304547 0.290315 O\n0.701551 0.304547 0.790315 O\n0.201551 0.695453 0.709685 O\n0.285076 0.495859 0.309085 O\n0.785076 0.504141 0.190915 O\n0.714924 0.504141 0.690915 O\n0.214924 0.495859 0.809085 O\n0.656266 0.837574 0.047304 O\n0.156266 0.162426 0.452696 O\n0.343734 0.162426 0.952696 O\n0.843734 0.837574 0.547304 O\n0.331261 0.254540 0.074814 O\n0.831261 0.745460 0.425186 O\n0.668739 0.745460 0.925186 O\n0.168739 0.254540 0.574814 O\n0.503157 0.245962 0.021364 O\n0.003157 0.754038 0.478636 O\n0.496843 0.754038 0.978636 O\n0.996843 0.245962 0.521364 O\n0.697106 0.211024 0.032822 O\n0.197106 0.788976 0.467178 O\n0.302894 0.788976 0.967178 O\n0.802894 0.211024 0.532822 O\n0.381091 0.671752 0.074503 O\n0.881091 0.328248 0.425497 O\n0.618909 0.328248 0.925497 O\n0.118909 0.671752 0.574503 O\n0.407546 0.975037 0.047663 O\n0.907546 0.024963 0.452337 O\n0.592454 0.024963 0.952337 O\n0.092454 0.975037 0.547663 O\n0.078814 0.964455 0.269762 O\n0.578814 0.035545 0.230238 O\n0.921186 0.035545 0.730238 O\n0.421186 0.964455 0.769762 O\n0.182075 0.481141 0.017391 O\n0.682075 0.518859 0.482609 O\n0.817925 0.518859 0.982609 O\n0.317925 0.481141 0.517391 O\n0.639401 0.011395 0.471386 O\n0.139401 0.988605 0.028614 O\n0.360599 0.988605 0.528614 O\n0.860599 0.011395 0.971386 O\n0.051934 0.598873 0.338115 O\n0.551934 0.401127 0.161885 O\n0.948066 0.401127 0.661885 O\n0.448066 0.598873 0.838115 O\n",
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"elements": [
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"formula_full": "K8 Ca8 P24 H32 O88",
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"updated_at": "2021-11-28T01:36:21.185000Z",
"spacegroup": 14
},
{
"id": "mp-23274",
"created_at": "2022-09-04T14:48:28.933427Z",
"structure_string": "Ta48 Cl120\n1.0\n-10.380464 10.380464 10.380464\n10.380464 -10.380464 10.380464\n10.380464 10.380464 -10.380464\nTa Cl\n48 120\ndirect\n0.042046 0.132514 0.024922 Ta\n0.132514 0.607592 0.090468 Ta\n0.017124 0.042046 0.409532 Ta\n0.409532 0.017124 0.042046 Ta\n0.024922 0.482876 0.892408 Ta\n0.892408 0.024922 0.482876 Ta\n0.607592 0.090468 0.132515 Ta\n0.017124 0.475078 0.607592 Ta\n0.409532 0.892408 0.367485 Ta\n0.482876 0.090468 0.457954 Ta\n0.475078 0.607592 0.017124 Ta\n0.367485 0.409532 0.892408 Ta\n0.090468 0.457954 0.482876 Ta\n0.024922 0.042046 0.132514 Ta\n0.132514 0.024922 0.042046 Ta\n0.607592 0.017124 0.475078 Ta\n0.367486 0.457954 0.475078 Ta\n0.892408 0.367485 0.409532 Ta\n0.475078 0.367486 0.457954 Ta\n0.457954 0.482876 0.090468 Ta\n0.457954 0.475078 0.367486 Ta\n0.482876 0.892408 0.024922 Ta\n0.090468 0.132514 0.607592 Ta\n0.042046 0.409532 0.017124 Ta\n0.957954 0.867485 0.975078 Ta\n0.867486 0.392408 0.909532 Ta\n0.982876 0.957954 0.590468 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"updated_at": "2021-11-28T01:39:42.020000Z",
"spacegroup": 230
}
]
}