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{
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"structure_string": "Li2 Al2 P2 O8 F2\n1.0\n5.128131 0.000000 0.000000\n-0.720862 5.142792 0.000000\n-2.179092 -2.424063 6.174057\nLi Al P O F\n2 2 2 8 2\ndirect\n0.268037 0.620332 0.236762 Li\n0.731963 0.379668 0.763238 Li\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.325609 0.643827 0.753395 P\n0.674391 0.356173 0.246605 P\n0.128940 0.682739 0.885926 O\n0.247474 0.781737 0.582913 O\n0.300817 0.327981 0.647105 O\n0.641903 0.760490 0.902469 O\n0.358097 0.239510 0.097531 O\n0.699183 0.672019 0.352895 O\n0.752526 0.218263 0.417087 O\n0.871060 0.317261 0.114074 O\n0.096963 0.934278 0.257163 F\n0.903037 0.065722 0.742837 F\n",
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{
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"formula_full": "Li4 Fe4 C4 O16",
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{
"id": "mp-1211610",
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"structure_string": "Li4 La4 C16 O40\n1.0\n7.680808 0.000000 0.000000\n0.000000 9.644049 0.000000\n0.000000 3.358620 12.486193\nLi La C O\n4 4 16 40\ndirect\n0.308982 0.589788 0.298903 Li\n0.691018 0.410212 0.701097 Li\n0.308982 0.910212 0.701097 Li\n0.691018 0.089788 0.298903 Li\n0.778994 0.715644 0.254258 La\n0.221006 0.284356 0.745742 La\n0.778994 0.784356 0.745742 La\n0.221006 0.215644 0.254258 La\n0.828619 0.366547 0.277272 C\n0.171381 0.633453 0.722728 C\n0.828619 0.133453 0.722728 C\n0.171381 0.866547 0.277272 C\n0.875182 0.750000 0.000000 C\n0.124818 0.250000 0.000000 C\n0.671696 0.750000 0.000000 C\n0.328304 0.250000 0.000000 C\n0.372344 0.880259 0.285218 C\n0.627656 0.119741 0.714782 C\n0.372344 0.619741 0.714782 C\n0.627656 0.380259 0.285218 C\n0.776215 0.833924 0.479063 C\n0.223785 0.166076 0.520937 C\n0.776215 0.666076 0.520937 C\n0.223785 0.333924 0.479063 C\n0.566346 0.504499 0.277563 O\n0.433654 0.495501 0.722437 O\n0.566346 0.995501 0.722437 O\n0.433654 0.004499 0.277563 O\n0.948868 0.765684 0.083767 O\n0.051132 0.234316 0.916233 O\n0.948868 0.734316 0.916233 O\n0.051132 0.265684 0.083767 O\n0.598007 0.752864 0.086990 O\n0.401993 0.247136 0.913010 O\n0.598007 0.747136 0.913010 O\n0.401993 0.252864 0.086990 O\n0.769769 0.885385 0.377643 O\n0.230231 0.114615 0.622357 O\n0.769769 0.614615 0.622357 O\n0.230231 0.385385 0.377643 O\n0.261744 0.526721 0.122619 O\n0.738256 0.473279 0.877381 O\n0.261744 0.973279 0.877381 O\n0.738256 0.026721 0.122619 O\n0.778252 0.906243 0.547411 O\n0.221748 0.093757 0.452589 O\n0.778252 0.593757 0.452589 O\n0.221748 0.406243 0.547411 O\n0.458224 0.765421 0.295793 O\n0.541776 0.234579 0.704207 O\n0.458224 0.734579 0.704207 O\n0.541776 0.265421 0.295793 O\n0.889478 0.240304 0.292905 O\n0.110522 0.759696 0.707095 O\n0.889478 0.259696 0.707095 O\n0.110522 0.740304 0.292905 O\n0.732783 0.416695 0.974434 O\n0.267217 0.583305 0.025566 O\n0.732783 0.083305 0.025566 O\n0.267217 0.916695 0.974434 O\n0.915660 0.481689 0.253138 O\n0.084340 0.518311 0.746862 O\n0.915660 0.018311 0.746862 O\n0.084340 0.981689 0.253138 O\n",
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"formula_full": "Li4 La4 C16 O40",
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{
"id": "mp-504939",
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"structure_string": "V2 Cu3 H24 O12 F12\n1.0\n7.609203 0.000000 0.000000\n-0.558223 7.592812 0.000000\n-0.014223 -0.258141 8.291855\nV Cu H O F\n2 3 24 12 12\ndirect\n0.000000 0.500000 0.000000 V\n0.500000 0.000000 0.500000 V\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n0.213223 0.987692 0.761566 H\n0.786777 0.012308 0.238434 H\n0.111081 0.795482 0.783901 H\n0.888919 0.204518 0.216099 H\n0.234819 0.976640 0.223998 H\n0.765181 0.023360 0.776002 H\n0.278712 0.853945 0.073277 H\n0.721288 0.146055 0.926723 H\n0.120651 0.183486 0.486519 H\n0.879349 0.816514 0.513481 H\n0.926889 0.164105 0.556334 H\n0.073111 0.835895 0.443666 H\n0.244565 0.551867 0.301965 H\n0.755435 0.448133 0.698035 H\n0.326754 0.608046 0.477853 H\n0.673246 0.391954 0.522147 H\n0.508222 0.263409 0.212816 H\n0.491778 0.736591 0.787184 H\n0.390741 0.170811 0.071680 H\n0.609259 0.829189 0.928320 H\n0.283053 0.463022 0.778608 H\n0.716947 0.536978 0.221392 H\n0.398282 0.292486 0.761004 H\n0.601718 0.707514 0.238996 H\n0.097625 0.925623 0.788789 O\n0.902375 0.074377 0.211211 O\n0.239583 0.971532 0.102092 O\n0.760417 0.028468 0.897908 O\n0.033441 0.246471 0.548909 O\n0.966559 0.753529 0.451091 O\n0.244102 0.521074 0.418375 O\n0.755898 0.478926 0.581625 O\n0.491775 0.258244 0.093322 O\n0.508225 0.741756 0.906678 O\n0.403934 0.421796 0.789036 O\n0.596066 0.578204 0.210964 O\n0.101640 0.279417 0.969573 F\n0.898360 0.720583 0.030427 F\n0.107599 0.581351 0.788379 F\n0.892401 0.418649 0.211621 F\n0.218461 0.596232 0.112494 F\n0.781539 0.403768 0.887506 F\n0.406405 0.093171 0.705632 F\n0.593595 0.906829 0.294368 F\n0.249783 0.991632 0.411020 F\n0.750217 0.008368 0.588980 F\n0.449751 0.764869 0.583510 F\n0.550249 0.235131 0.416490 F\n",
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{
"id": "mp-1180048",
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"structure_string": "Pt12 S12 N4 O56\n1.0\n10.134886 -6.059089 0.000000\n10.134886 6.059089 0.000000\n6.512491 0.000000 9.849666\nPt S N O\n12 12 4 56\ndirect\n0.197750 0.746803 0.151256 Pt\n0.746803 0.151256 0.197750 Pt\n0.151256 0.197750 0.746803 Pt\n0.802250 0.253197 0.848744 Pt\n0.253197 0.848744 0.802250 Pt\n0.848744 0.802250 0.253197 Pt\n0.273268 0.960231 0.017368 Pt\n0.960231 0.017368 0.273268 Pt\n0.017368 0.273268 0.960231 Pt\n0.726732 0.039769 0.982633 Pt\n0.039769 0.982633 0.726732 Pt\n0.982633 0.726732 0.039769 Pt\n0.255826 0.837278 0.319845 S\n0.837278 0.319845 0.255826 S\n0.319845 0.255826 0.837278 S\n0.744174 0.162722 0.680155 S\n0.162722 0.680155 0.744174 S\n0.680155 0.744174 0.162722 S\n0.488820 0.700965 0.946484 S\n0.700965 0.946484 0.488820 S\n0.946484 0.488820 0.700965 S\n0.511180 0.299035 0.053516 S\n0.299035 0.053516 0.511180 S\n0.053516 0.511180 0.299035 S\n0.602586 0.602586 0.602586 N\n0.397414 0.397414 0.397414 N\n0.795106 0.795106 0.795106 N\n0.204894 0.204894 0.204894 N\n0.088631 0.088631 0.088631 O\n0.911369 0.911369 0.911369 O\n0.002009 0.848684 0.235478 O\n0.848684 0.235478 0.002009 O\n0.235478 0.002009 0.848684 O\n0.997991 0.151316 0.764522 O\n0.151316 0.764522 0.997991 O\n0.764522 0.997991 0.151316 O\n0.112957 0.923005 0.372277 O\n0.923005 0.372277 0.112957 O\n0.372277 0.112957 0.923005 O\n0.887043 0.076995 0.627723 O\n0.076995 0.627723 0.887043 O\n0.627723 0.887043 0.076995 O\n0.323836 0.922085 0.176421 O\n0.922085 0.176421 0.323836 O\n0.176421 0.323836 0.922085 O\n0.676164 0.077915 0.823579 O\n0.077915 0.823579 0.676164 O\n0.823579 0.676164 0.077915 O\n0.208011 0.593883 0.667973 O\n0.593883 0.667973 0.208011 O\n0.667973 0.208011 0.593883 O\n0.791989 0.406117 0.332027 O\n0.406117 0.332027 0.791989 O\n0.332027 0.791989 0.406117 O\n0.252662 0.716085 0.305586 O\n0.716085 0.305586 0.252662 O\n0.305586 0.252662 0.716085 O\n0.747338 0.283915 0.694414 O\n0.283915 0.694414 0.747338 O\n0.694414 0.747338 0.283915 O\n0.464423 0.840907 0.947457 O\n0.840907 0.947457 0.464423 O\n0.947457 0.464423 0.840907 O\n0.535577 0.159093 0.052543 O\n0.159093 0.052543 0.535577 O\n0.052543 0.535577 0.159093 O\n0.627481 0.620068 0.933646 O\n0.620068 0.933646 0.627481 O\n0.933646 0.627481 0.620068 O\n0.372519 0.379932 0.066354 O\n0.379932 0.066354 0.372519 O\n0.066354 0.372519 0.379932 O\n0.395117 0.634153 0.082450 O\n0.634153 0.082450 0.395117 O\n0.082450 0.395117 0.634153 O\n0.604883 0.365847 0.917550 O\n0.365847 0.917550 0.604883 O\n0.917550 0.604883 0.365847 O\n0.166615 0.550218 0.279032 O\n0.550218 0.279032 0.166615 O\n0.279032 0.166615 0.550218 O\n0.833385 0.449782 0.720968 O\n0.449782 0.720968 0.833385 O\n0.720968 0.833385 0.449782 O\n",
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{
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"structure_string": "Dy4 Mn24 Ga10\n1.0\n4.271133 -7.397820 0.000000\n4.271133 7.397820 0.000000\n0.000000 0.000000 8.450497\nDy Mn Ga\n4 24 10\ndirect\n0.000000 0.000000 0.250000 Dy\n0.000000 0.000000 0.750000 Dy\n0.333333 0.666667 0.750000 Dy\n0.666667 0.333333 0.250000 Dy\n0.323888 0.353610 0.250000 Mn\n0.646390 0.970278 0.250000 Mn\n0.029722 0.676112 0.250000 Mn\n0.646390 0.676112 0.250000 Mn\n0.029722 0.353610 0.250000 Mn\n0.323888 0.970278 0.250000 Mn\n0.676112 0.646390 0.750000 Mn\n0.353610 0.029722 0.750000 Mn\n0.970278 0.323888 0.750000 Mn\n0.353610 0.323888 0.750000 Mn\n0.970278 0.646390 0.750000 Mn\n0.676112 0.029722 0.750000 Mn\n0.154880 0.845120 0.507036 Mn\n0.154880 0.309760 0.507036 Mn\n0.690240 0.845120 0.507036 Mn\n0.845120 0.154880 0.492964 Mn\n0.845120 0.690240 0.492964 Mn\n0.309760 0.154880 0.492964 Mn\n0.845120 0.154880 0.007036 Mn\n0.845120 0.690240 0.007036 Mn\n0.309760 0.154880 0.007036 Mn\n0.154880 0.845120 0.992964 Mn\n0.154880 0.309760 0.992964 Mn\n0.690240 0.845120 0.992964 Mn\n0.333333 0.666667 0.394547 Ga\n0.666667 0.333333 0.605453 Ga\n0.666667 0.333333 0.894547 Ga\n0.333333 0.666667 0.105453 Ga\n0.500000 0.500000 0.500000 Ga\n0.500000 0.000000 0.500000 Ga\n0.000000 0.500000 0.500000 Ga\n0.500000 0.500000 0.000000 Ga\n0.500000 0.000000 0.000000 Ga\n0.000000 0.500000 0.000000 Ga\n",
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{
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"structure_string": "Al2 Co4 O8\n1.0\n-2.924327 2.957816 4.060827\n2.924327 -2.957816 4.060827\n2.924327 2.957816 -4.060827\nAl Co O\n2 4 8\ndirect\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Co\n0.121728 0.371728 0.750000 Co\n0.000000 0.000000 0.000000 Co\n0.878272 0.628272 0.250000 Co\n0.293233 0.761529 0.531704 O\n0.729825 0.761529 0.968296 O\n0.731768 0.216107 0.984339 O\n0.731768 0.747429 0.515661 O\n0.268232 0.252571 0.484339 O\n0.268232 0.783893 0.015661 O\n0.706767 0.238471 0.468296 O\n0.270175 0.238471 0.031704 O\n",
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