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{
"id": "mp-1238827",
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"structure_string": "Cr4 Ag2 S8\n1.0\n0.000000 5.091867 5.091867\n5.091867 0.000000 5.091867\n5.091867 5.091867 0.000000\nCr Ag S\n4 2 8\ndirect\n0.125000 0.125000 0.125000 Cr\n0.625000 0.125000 0.125000 Cr\n0.125000 0.625000 0.125000 Cr\n0.125000 0.125000 0.625000 Cr\n0.500000 0.500000 0.500000 Ag\n0.750000 0.750000 0.750000 Ag\n0.359848 0.359848 0.359848 S\n0.329544 0.890152 0.890152 S\n0.890152 0.890152 0.329544 S\n0.890152 0.329544 0.890152 S\n0.359848 0.359848 0.920456 S\n0.359848 0.920456 0.359848 S\n0.890152 0.890152 0.890152 S\n0.920456 0.359848 0.359848 S\n",
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{
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"structure_string": "Na2 Li6 Fe8 Si16 O48\n1.0\n5.366101 0.000000 0.000000\n1.670159 6.385538 0.000000\n1.313183 1.110764 25.510745\nNa Li Fe Si O\n2 6 8 16 48\ndirect\n0.824000 0.709403 0.571824 Na\n0.072006 0.708780 0.823045 Na\n0.309295 0.749699 0.064025 Li\n0.936052 0.250419 0.187751 Li\n0.189437 0.252122 0.436789 Li\n0.561705 0.749339 0.313044 Li\n0.438042 0.252078 0.686516 Li\n0.684101 0.250728 0.937541 Li\n0.473692 0.102949 0.224549 Fe\n0.770906 0.898128 0.026782 Fe\n0.024875 0.897775 0.275263 Fe\n0.729045 0.101757 0.473256 Fe\n0.279772 0.897957 0.524052 Fe\n0.974752 0.101989 0.724229 Fe\n0.219205 0.103324 0.975432 Fe\n0.525683 0.898577 0.775593 Fe\n0.326929 0.207649 0.096818 Si\n0.782287 0.386039 0.052011 Si\n0.034639 0.386541 0.300964 Si\n0.465019 0.615044 0.198226 Si\n0.579050 0.208692 0.345617 Si\n0.919931 0.793573 0.153953 Si\n0.170963 0.793971 0.402459 Si\n0.302355 0.382392 0.550358 Si\n0.714373 0.616420 0.446537 Si\n0.844065 0.205895 0.595195 Si\n0.091881 0.205105 0.846395 Si\n0.406037 0.796959 0.653892 Si\n0.550126 0.382124 0.801423 Si\n0.953047 0.616927 0.698328 Si\n0.204040 0.615805 0.949821 Si\n0.655237 0.797025 0.905324 Si\n0.396907 0.031051 0.051022 O\n0.853522 0.202946 0.007793 O\n0.033564 0.354502 0.088404 O\n0.323542 0.113228 0.156428 O\n0.533470 0.353742 0.088622 O\n0.694438 0.625241 0.028501 O\n0.107492 0.202284 0.257118 O\n0.214804 0.647506 0.161219 O\n0.649603 0.031701 0.299831 O\n0.552372 0.375516 0.221425 O\n0.714136 0.646827 0.161401 O\n0.922620 0.888852 0.094174 O\n0.285722 0.355761 0.337326 O\n0.574866 0.115674 0.405337 O\n0.392031 0.798774 0.242096 O\n0.785273 0.355011 0.337474 O\n0.947318 0.625441 0.277232 O\n0.848751 0.969799 0.199615 O\n0.366055 0.198049 0.507054 O\n0.173000 0.890583 0.342875 O\n0.465674 0.646992 0.409198 O\n0.908337 0.037226 0.548049 O\n0.803325 0.377762 0.470443 O\n0.964585 0.647893 0.409954 O\n0.052146 0.353197 0.588039 O\n0.223921 0.618284 0.525047 O\n0.101831 0.969682 0.448365 O\n0.551039 0.356668 0.587375 O\n0.833758 0.112187 0.654985 O\n0.640571 0.803263 0.489444 O\n0.155513 0.036575 0.799300 O\n0.044764 0.378829 0.722109 O\n0.200609 0.649331 0.660896 O\n0.612093 0.198866 0.757768 O\n0.401066 0.896875 0.594845 O\n0.700803 0.646857 0.661623 O\n0.082013 0.109934 0.906058 O\n0.300337 0.352072 0.839214 O\n0.471240 0.618373 0.776421 O\n0.346299 0.970631 0.700139 O\n0.798923 0.355773 0.838488 O\n0.884574 0.804603 0.740859 O\n0.293610 0.376791 0.972865 O\n0.451142 0.648122 0.912331 O\n0.649925 0.896386 0.846188 O\n0.950730 0.648232 0.913261 O\n0.135945 0.800107 0.993355 O\n0.593191 0.970811 0.951423 O\n",
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"formula_full": "Na2 Li6 Fe8 Si16 O48",
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"spacegroup": 1
},
{
"id": "mp-557320",
"created_at": "2022-09-04T14:40:52.070622Z",
"structure_string": "K4 Re2 Cl10 O1\n1.0\n-3.587177 3.587177 8.963644\n3.587177 -3.587177 8.963644\n3.587177 3.587177 -8.963644\nK Re Cl O\n4 2 10 1\ndirect\n0.500000 0.000000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.750000 0.250000 0.500000 K\n0.000000 0.500000 0.500000 K\n0.103550 0.103550 0.000000 Re\n0.896450 0.896450 0.000000 Re\n0.124688 0.651233 0.000000 Cl\n0.238522 0.238522 0.000000 Cl\n0.651233 0.124688 0.000000 Cl\n0.875312 0.875312 0.526545 Cl\n0.124688 0.124688 0.473455 Cl\n0.875312 0.348767 0.000000 Cl\n0.348767 0.348767 0.473455 Cl\n0.761478 0.761478 0.000000 Cl\n0.651233 0.651233 0.526545 Cl\n0.348767 0.875312 0.000000 Cl\n0.000000 0.000000 0.000000 O\n",
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"formula_full": "K4 Re2 Cl10 O1",
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"updated_at": "2021-11-28T01:35:13.368000Z",
"spacegroup": 139
},
{
"id": "mp-1259488",
"created_at": "2022-09-04T14:40:52.083282Z",
"structure_string": "Li4 Fe4 Si8 O24\n1.0\n7.782414 0.021100 0.000461\n0.021096 7.782313 0.000267\n0.000552 0.000351 9.589667\nLi Fe Si O\n4 4 8 24\ndirect\n0.172018 0.172074 0.499993 Li\n0.400725 0.599295 0.250003 Li\n0.599251 0.400804 0.749991 Li\n0.827933 0.827984 0.999988 Li\n0.131835 0.313520 0.763783 Fe\n0.313617 0.131741 0.236273 Fe\n0.686453 0.868122 0.736197 Fe\n0.868183 0.686474 0.263788 Fe\n0.109613 0.890392 0.750007 Si\n0.166845 0.598902 0.512346 Si\n0.401092 0.833122 0.987671 Si\n0.429252 0.429205 0.999999 Si\n0.570732 0.570740 0.500003 Si\n0.598875 0.166844 0.487655 Si\n0.833162 0.401187 0.012337 Si\n0.890405 0.109632 0.249981 Si\n0.944045 0.365274 0.873245 O\n0.137247 0.085221 0.691147 O\n0.130845 0.412014 0.582335 O\n0.148175 0.755173 0.623657 O\n0.244820 0.851894 0.876382 O\n0.085207 0.137289 0.308842 O\n0.367876 0.598673 0.453531 O\n0.337276 0.377473 0.854787 O\n0.377548 0.337187 0.145210 O\n0.365252 0.943950 0.126800 O\n0.401287 0.632080 0.046466 O\n0.587974 0.869107 0.917656 O\n0.412002 0.130806 0.417727 O\n0.598640 0.367861 0.546468 O\n0.634765 0.055947 0.626746 O\n0.622480 0.662705 0.645213 O\n0.662741 0.622488 0.354793 O\n0.632161 0.401381 0.953500 O\n0.914753 0.862693 0.808799 O\n0.755172 0.148112 0.376352 O\n0.851891 0.244902 0.123634 O\n0.869172 0.588052 0.082316 O\n0.862694 0.914818 0.191125 O\n0.055988 0.634861 0.373255 O\n",
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{
"id": "mp-865537",
"created_at": "2022-09-04T14:41:03.591880Z",
"structure_string": "Ti1 Mn1 Co2\n1.0\n0.000000 2.921167 2.921167\n2.921167 0.000000 2.921167\n2.921167 2.921167 0.000000\nTi Mn Co\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 Mn\n0.250000 0.250000 0.250000 Co\n0.750000 0.750000 0.750000 Co\n",
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{
"id": "mp-1644086",
"created_at": "2022-09-04T14:40:57.171215Z",
"structure_string": "Na8 V4 B4 P4 O28\n1.0\n0.233420 6.474564 5.433759\n0.247243 -6.491923 5.453950\n9.003936 -0.001168 -5.265674\nNa V B P O\n8 4 4 4 28\ndirect\n0.720086 0.719061 0.205233 Na\n0.219984 0.222244 0.207949 Na\n0.471703 0.968910 0.206990 Na\n0.969264 0.468536 0.203582 Na\n0.024238 0.531072 0.794344 Na\n0.532588 0.034080 0.798257 Na\n0.779005 0.773706 0.791924 Na\n0.282419 0.281734 0.797757 Na\n0.436967 0.686502 0.344199 V\n0.067292 0.816561 0.660656 V\n0.934109 0.187725 0.343119 V\n0.559050 0.309605 0.653699 V\n0.784817 0.031451 0.083829 B\n0.283205 0.535648 0.084557 B\n0.715090 0.465554 0.913732 B\n0.222479 0.972673 0.916585 B\n0.712009 0.462549 0.439575 P\n0.212018 0.963132 0.438663 P\n0.787113 0.035380 0.560758 P\n0.285390 0.536615 0.560307 P\n0.309570 0.059804 0.054711 O\n0.810834 0.560848 0.049057 O\n0.188178 0.443038 0.948535 O\n0.692783 0.937211 0.947664 O\n0.928536 0.177946 0.150024 O\n0.429510 0.678918 0.150431 O\n0.570759 0.320950 0.849799 O\n0.074108 0.824299 0.847100 O\n0.752722 0.999162 0.206675 O\n0.251370 0.503213 0.207663 O\n0.744290 0.495249 0.788832 O\n0.256436 0.006644 0.797767 O\n0.644387 0.890950 0.423142 O\n0.140141 0.396017 0.422447 O\n0.853318 0.602058 0.578984 O\n0.356860 0.106616 0.578061 O\n0.591248 0.342281 0.480796 O\n0.091310 0.843658 0.479219 O\n0.904827 0.152507 0.516400 O\n0.406232 0.651675 0.516760 O\n0.606024 0.546861 0.344936 O\n0.108696 0.051557 0.346961 O\n0.796678 0.354584 0.345654 O\n0.300766 0.858606 0.347854 O\n0.702804 0.140361 0.655020 O\n0.202314 0.650442 0.652143 O\n0.898615 0.950833 0.652685 O\n0.387860 0.450972 0.654966 O\n",
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"formula_full": "Na8 V4 B4 P4 O28",
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{
"id": "mp-857344",
"created_at": "2022-09-04T14:41:00.501509Z",
"structure_string": "Li8 Mn8 P8 O32\n1.0\n4.910701 0.000000 0.000000\n0.000000 7.601092 0.000000\n0.000000 0.000000 17.093336\nLi Mn P O\n8 8 8 32\ndirect\n0.242917 0.512458 0.052857 Li\n0.242917 0.012458 0.447143 Li\n0.288166 0.318162 0.356818 Li\n0.288166 0.818162 0.143182 Li\n0.742917 0.987542 0.552857 Li\n0.742917 0.487542 0.947143 Li\n0.788166 0.181838 0.856818 Li\n0.788166 0.681838 0.643182 Li\n0.289224 0.341220 0.552087 Mn\n0.289224 0.841220 0.947913 Mn\n0.358307 0.040568 0.752761 Mn\n0.358307 0.540568 0.747239 Mn\n0.789224 0.158780 0.052087 Mn\n0.789224 0.658780 0.447913 Mn\n0.858307 0.959432 0.247239 Mn\n0.858307 0.459432 0.252761 Mn\n0.237431 0.214745 0.174133 P\n0.237431 0.714745 0.325867 P\n0.252479 0.259616 0.925479 P\n0.252479 0.759616 0.574521 P\n0.737431 0.785255 0.825867 P\n0.737431 0.285255 0.674133 P\n0.752479 0.240384 0.425479 P\n0.752479 0.740384 0.074521 P\n0.050546 0.294207 0.663329 O\n0.050546 0.794207 0.836671 O\n0.061790 0.739239 0.054651 O\n0.061790 0.239239 0.445349 O\n0.117489 0.929979 0.545364 O\n0.117489 0.429979 0.954636 O\n0.187945 0.737956 0.663699 O\n0.187945 0.237956 0.836301 O\n0.095039 0.543073 0.356247 O\n0.095039 0.043073 0.143753 O\n0.150209 0.726794 0.238772 O\n0.150209 0.226794 0.261228 O\n0.095817 0.372079 0.132627 O\n0.095817 0.872079 0.367373 O\n0.114728 0.598500 0.532299 O\n0.114728 0.098500 0.967701 O\n0.550546 0.205793 0.163329 O\n0.550546 0.705793 0.336671 O\n0.561790 0.260761 0.945349 O\n0.561790 0.760761 0.554651 O\n0.617489 0.070021 0.454636 O\n0.617489 0.570021 0.045364 O\n0.687945 0.262044 0.336301 O\n0.687945 0.762044 0.163699 O\n0.595039 0.956927 0.856247 O\n0.595039 0.456927 0.643753 O\n0.650209 0.773206 0.738772 O\n0.650209 0.273206 0.761228 O\n0.595817 0.627921 0.867373 O\n0.595817 0.127921 0.632627 O\n0.614728 0.401500 0.467701 O\n0.614728 0.901500 0.032299 O\n",
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{
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