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{
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"structure_string": "Ti12 Fe12 Si24\n1.0\n7.579203 0.000000 0.000000\n0.000000 8.575498 0.000000\n0.000000 0.000000 9.530448\nTi Fe Si\n12 12 24\ndirect\n0.000000 0.167474 0.820286 Ti\n0.238435 0.173945 0.548537 Ti\n0.761565 0.326055 0.048537 Ti\n0.761565 0.673945 0.951463 Ti\n0.761565 0.173945 0.548537 Ti\n0.761565 0.826055 0.451463 Ti\n0.238435 0.673945 0.951463 Ti\n0.238435 0.326055 0.048537 Ti\n0.000000 0.332526 0.320286 Ti\n0.000000 0.667474 0.679714 Ti\n0.000000 0.832526 0.179714 Ti\n0.238435 0.826055 0.451463 Ti\n0.248746 0.089838 0.257347 Fe\n0.248746 0.589838 0.242653 Fe\n0.248746 0.410162 0.757347 Fe\n0.751254 0.089838 0.257347 Fe\n0.751254 0.910162 0.742653 Fe\n0.751254 0.410162 0.757347 Fe\n0.751254 0.589838 0.242653 Fe\n0.248746 0.910162 0.742653 Fe\n0.244065 0.000000 0.000000 Fe\n0.755935 0.500000 0.500000 Fe\n0.755935 0.000000 0.000000 Fe\n0.244065 0.500000 0.500000 Fe\n0.500000 0.039544 0.377959 Si\n0.000000 0.461371 0.880210 Si\n0.000000 0.538629 0.119790 Si\n0.000000 0.961371 0.619790 Si\n0.000000 0.038629 0.380210 Si\n0.000000 0.374206 0.604098 Si\n0.000000 0.625794 0.395902 Si\n0.000000 0.874206 0.895902 Si\n0.500000 0.378070 0.598396 Si\n0.500000 0.621930 0.401604 Si\n0.500000 0.878070 0.901604 Si\n0.500000 0.121930 0.098396 Si\n0.500000 0.460456 0.877959 Si\n0.500000 0.539544 0.122041 Si\n0.500000 0.960456 0.622041 Si\n0.000000 0.125794 0.104098 Si\n0.344602 0.338520 0.318675 Si\n0.655398 0.838520 0.181325 Si\n0.344602 0.838520 0.181325 Si\n0.655398 0.161480 0.818675 Si\n0.655398 0.661480 0.681325 Si\n0.655398 0.338520 0.318675 Si\n0.344602 0.161480 0.818675 Si\n0.344602 0.661480 0.681325 Si\n",
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{
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"structure_string": "Zn4 In8 O16\n1.0\n3.335970 0.000000 0.000000\n0.000000 10.544703 0.000000\n0.000000 0.000000 10.700138\nZn In O\n4 8 16\ndirect\n0.750000 0.131484 0.584024 Zn\n0.250000 0.368516 0.084024 Zn\n0.750000 0.631484 0.915976 Zn\n0.250000 0.868516 0.415976 Zn\n0.750000 0.137772 0.284741 In\n0.750000 0.112230 0.917825 In\n0.250000 0.387770 0.417825 In\n0.250000 0.362228 0.784741 In\n0.750000 0.637772 0.215259 In\n0.750000 0.612230 0.582175 In\n0.250000 0.887770 0.082175 In\n0.250000 0.862228 0.715259 In\n0.750000 0.023741 0.112462 O\n0.750000 0.959618 0.626232 O\n0.250000 0.272449 0.242404 O\n0.750000 0.259948 0.459949 O\n0.250000 0.240052 0.959949 O\n0.750000 0.227551 0.742404 O\n0.250000 0.540382 0.126232 O\n0.250000 0.476259 0.612462 O\n0.750000 0.523741 0.387538 O\n0.750000 0.459618 0.873768 O\n0.250000 0.772449 0.257596 O\n0.750000 0.759948 0.040051 O\n0.250000 0.740052 0.540051 O\n0.750000 0.727551 0.757596 O\n0.250000 0.040382 0.373768 O\n0.250000 0.976259 0.887538 O\n",
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"formula_full": "Zn4 In8 O16",
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},
{
"id": "mp-758004",
"created_at": "2022-09-04T14:40:18.091815Z",
"structure_string": "K6 Nb14 O38\n1.0\n6.567037 0.000000 0.000000\n-2.875287 9.696032 0.000000\n-1.427865 -2.345740 14.126088\nK Nb O\n6 14 38\ndirect\n0.006250 0.823661 0.904349 K\n0.588552 0.408819 0.789542 K\n0.358494 0.023527 0.634175 K\n0.641506 0.976473 0.365825 K\n0.411448 0.591181 0.210458 K\n0.993750 0.176339 0.095651 K\n0.220847 0.528265 0.963281 Nb\n0.564451 0.091151 0.889061 Nb\n0.003386 0.155047 0.812093 Nb\n0.380382 0.706462 0.740816 Nb\n0.170870 0.316535 0.580522 Nb\n0.842222 0.780419 0.652156 Nb\n0.366594 0.621452 0.505229 Nb\n0.633406 0.378548 0.494771 Nb\n0.157778 0.219581 0.347844 Nb\n0.829130 0.683465 0.419478 Nb\n0.619618 0.293538 0.259184 Nb\n0.996614 0.844953 0.187907 Nb\n0.435549 0.908849 0.110939 Nb\n0.779153 0.471735 0.036719 Nb\n0.500000 0.500000 0.000000 O\n0.674377 0.276024 0.969266 O\n0.500000 0.000000 0.000000 O\n0.880706 0.064606 0.910580 O\n0.127347 0.340241 0.878890 O\n0.912948 0.547749 0.933145 O\n0.298450 0.114180 0.840990 O\n0.286966 0.604805 0.836336 O\n0.711817 0.165753 0.777721 O\n0.464997 0.890991 0.805676 O\n0.107657 0.234427 0.685979 O\n0.673085 0.685477 0.746549 O\n0.092863 0.729691 0.685302 O\n0.931373 0.961609 0.718823 O\n0.286873 0.525584 0.626302 O\n0.478047 0.307586 0.594957 O\n0.503599 0.782543 0.606247 O\n0.891220 0.352003 0.539714 O\n0.689243 0.583985 0.545562 O\n0.094169 0.162758 0.474199 O\n0.905831 0.837242 0.525801 O\n0.310757 0.416015 0.454438 O\n0.108780 0.647997 0.460286 O\n0.496401 0.217457 0.393753 O\n0.521953 0.692414 0.405043 O\n0.713127 0.474416 0.373698 O\n0.068627 0.038391 0.281177 O\n0.907137 0.270309 0.314698 O\n0.326915 0.314523 0.253451 O\n0.892343 0.765573 0.314021 O\n0.535003 0.109009 0.194324 O\n0.288183 0.834247 0.222279 O\n0.713034 0.395195 0.163664 O\n0.701550 0.885820 0.159010 O\n0.087052 0.452251 0.066855 O\n0.872653 0.659759 0.121110 O\n0.119294 0.935394 0.089420 O\n0.325623 0.723976 0.030734 O\n",
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],
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},
{
"id": "mp-16961",
"created_at": "2022-09-04T14:40:17.080358Z",
"structure_string": "Na12 Si4 Se14\n1.0\n5.470187 4.742986 0.000000\n-5.470187 4.742986 0.000000\n0.000000 4.052306 15.459316\nNa Si Se\n12 4 14\ndirect\n0.581546 0.418454 0.750000 Na\n0.418454 0.581546 0.250000 Na\n0.500000 0.500000 0.000000 Na\n0.500000 0.500000 0.500000 Na\n0.267158 0.971467 0.928586 Na\n0.028533 0.732842 0.571414 Na\n0.732842 0.028533 0.071414 Na\n0.971467 0.267158 0.428586 Na\n0.511312 0.955092 0.642110 Na\n0.044908 0.488688 0.857890 Na\n0.488688 0.044908 0.357890 Na\n0.955092 0.511312 0.142110 Na\n0.763843 0.923137 0.859222 Si\n0.076863 0.236157 0.640778 Si\n0.923137 0.763843 0.359222 Si\n0.236157 0.076863 0.140778 Si\n0.036032 0.963968 0.750000 Se\n0.963968 0.036032 0.250000 Se\n0.691275 0.200084 0.893765 Se\n0.799916 0.308725 0.606235 Se\n0.308725 0.799916 0.106235 Se\n0.200084 0.691275 0.393765 Se\n0.870189 0.740759 0.967152 Se\n0.259241 0.129811 0.532848 Se\n0.129811 0.259241 0.032848 Se\n0.740759 0.870189 0.467152 Se\n0.508521 0.755905 0.821096 Se\n0.244095 0.491479 0.678904 Se\n0.491479 0.244095 0.178904 Se\n0.755905 0.508521 0.321096 Se\n",
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{
"id": "mp-554617",
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"structure_string": "Rb24 U20 V8 O92\n1.0\n14.556212 0.000000 0.000000\n0.000000 7.241065 0.000000\n0.000000 0.128304 25.237451\nRb U V O\n24 20 8 92\ndirect\n0.625233 0.498603 0.745450 Rb\n0.403441 0.008812 0.166911 Rb\n0.903441 0.491188 0.333089 Rb\n0.557009 0.015510 0.653820 Rb\n0.531967 0.505476 0.919025 Rb\n0.442991 0.984490 0.346180 Rb\n0.031967 0.994524 0.580975 Rb\n0.596559 0.991188 0.833089 Rb\n0.942991 0.515510 0.153820 Rb\n0.056105 0.996865 0.923603 Rb\n0.443895 0.496865 0.423603 Rb\n0.943895 0.003135 0.076397 Rb\n0.000000 0.500000 0.500000 Rb\n0.057009 0.484490 0.846180 Rb\n0.968033 0.005476 0.419025 Rb\n0.500000 0.000000 0.500000 Rb\n0.000000 0.500000 0.000000 Rb\n0.874767 0.998603 0.245450 Rb\n0.096559 0.508812 0.666911 Rb\n0.374767 0.501397 0.254550 Rb\n0.468033 0.494524 0.080975 Rb\n0.500000 0.000000 0.000000 Rb\n0.556105 0.503135 0.576397 Rb\n0.125233 0.001397 0.754550 Rb\n0.270303 0.674722 0.543349 U\n0.226405 0.166757 0.462970 U\n0.273595 0.666757 0.962970 U\n0.812906 0.323052 0.619340 U\n0.770303 0.825278 0.956651 U\n0.830629 0.815163 0.680052 U\n0.801537 0.318859 0.896134 U\n0.229697 0.174722 0.043349 U\n0.698463 0.818859 0.396134 U\n0.687094 0.823052 0.119340 U\n0.187094 0.676948 0.380660 U\n0.729697 0.325278 0.456651 U\n0.330629 0.684837 0.819948 U\n0.726405 0.333243 0.037030 U\n0.312906 0.176948 0.880660 U\n0.773595 0.833243 0.537030 U\n0.198463 0.681141 0.103866 U\n0.669371 0.315163 0.180052 U\n0.301537 0.181141 0.603866 U\n0.169371 0.184837 0.319948 U\n0.139082 0.175095 0.165163 V\n0.387630 0.186344 0.756456 V\n0.360918 0.675095 0.665163 V\n0.612370 0.813656 0.243544 V\n0.860918 0.824905 0.834837 V\n0.112370 0.686344 0.256456 V\n0.639082 0.324905 0.334837 V\n0.887630 0.313656 0.743544 V\n0.458842 0.686547 0.823768 O\n0.605578 0.329618 0.476925 O\n0.192375 0.362750 0.395540 O\n0.541158 0.313453 0.176232 O\n0.846131 0.495852 0.701985 O\n0.394422 0.670382 0.523075 O\n0.653869 0.995852 0.201985 O\n0.189857 0.181958 0.858329 O\n0.313079 0.694393 0.727490 O\n0.813079 0.805607 0.772510 O\n0.847633 0.129271 0.704628 O\n0.316083 0.494641 0.892957 O\n0.737400 0.640587 0.469712 O\n0.225828 0.686325 0.462684 O\n0.652367 0.629271 0.204628 O\n0.810143 0.818042 0.141671 O\n0.061122 0.667897 0.396114 O\n0.689857 0.318042 0.641671 O\n0.816083 0.005359 0.607043 O\n0.650238 0.843731 0.559073 O\n0.331576 0.864461 0.623943 O\n0.024044 0.150567 0.169788 O\n0.648727 0.823831 0.931564 O\n0.795972 0.309363 0.187075 O\n0.686921 0.305607 0.272510 O\n0.691855 0.500899 0.374590 O\n0.807625 0.637250 0.604460 O\n0.995997 0.684220 0.252633 O\n0.681033 0.328438 0.871292 O\n0.318967 0.671562 0.128708 O\n0.181033 0.171562 0.628708 O\n0.425389 0.197028 0.584980 O\n0.204028 0.690637 0.812925 O\n0.152367 0.870729 0.295372 O\n0.735883 0.007224 0.466199 O\n0.764117 0.507224 0.966199 O\n0.004003 0.315780 0.747367 O\n0.262600 0.359413 0.530288 O\n0.041158 0.186547 0.323768 O\n0.074611 0.697028 0.084980 O\n0.351273 0.176169 0.068436 O\n0.105578 0.170382 0.023075 O\n0.308145 0.499101 0.625410 O\n0.346131 0.004148 0.798015 O\n0.925389 0.302972 0.915020 O\n0.975956 0.849433 0.830212 O\n0.725828 0.813675 0.037316 O\n0.658884 0.820074 0.306757 O\n0.341116 0.179926 0.693243 O\n0.849762 0.343731 0.059073 O\n0.683917 0.505359 0.107043 O\n0.274172 0.186325 0.962684 O\n0.704028 0.809363 0.687075 O\n0.938878 0.332103 0.603886 O\n0.841116 0.320074 0.806757 O\n0.186921 0.194393 0.227490 O\n0.153869 0.504148 0.298015 O\n0.396938 0.668999 0.985501 O\n0.958842 0.813453 0.676232 O\n0.524044 0.349433 0.330212 O\n0.894422 0.829618 0.976925 O\n0.692375 0.137250 0.104460 O\n0.191855 0.999101 0.125410 O\n0.561122 0.832103 0.103886 O\n0.504003 0.184220 0.752633 O\n0.762600 0.140587 0.969712 O\n0.438878 0.167897 0.896114 O\n0.808145 0.000899 0.874590 O\n0.349762 0.156269 0.440927 O\n0.495997 0.815780 0.247367 O\n0.295972 0.190637 0.312925 O\n0.574611 0.802972 0.415020 O\n0.774172 0.313675 0.537316 O\n0.310143 0.681958 0.358329 O\n0.168424 0.364461 0.123943 O\n0.347633 0.370729 0.795372 O\n0.158884 0.679926 0.193243 O\n0.896938 0.831001 0.514499 O\n0.183917 0.994641 0.392957 O\n0.307625 0.862750 0.895540 O\n0.148727 0.676169 0.568436 O\n0.237400 0.859413 0.030288 O\n0.851273 0.323831 0.431564 O\n0.264117 0.992776 0.533801 O\n0.831576 0.635539 0.876057 O\n0.475956 0.650567 0.669788 O\n0.668424 0.135539 0.376057 O\n0.150238 0.656269 0.940927 O\n0.235883 0.492776 0.033801 O\n0.103062 0.168999 0.485501 O\n0.818967 0.828438 0.371292 O\n0.603062 0.331001 0.014499 O\n",
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},
{
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