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{
"id": "mp-559257",
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"structure_string": "Ag8 Te8 O24\n1.0\n7.062034 0.000000 0.000000\n0.000000 6.643623 0.000000\n0.000000 0.185155 13.520830\nAg Te O\n8 8 24\ndirect\n0.183927 0.493748 0.931310 Ag\n0.316073 0.493748 0.431310 Ag\n0.446894 0.529451 0.197760 Ag\n0.683927 0.506252 0.568690 Ag\n0.553106 0.470549 0.802240 Ag\n0.053106 0.529451 0.697760 Ag\n0.816073 0.506252 0.068690 Ag\n0.946894 0.470549 0.302240 Ag\n0.133961 0.996391 0.409506 Te\n0.840053 0.860142 0.859857 Te\n0.659947 0.860142 0.359857 Te\n0.366039 0.996391 0.909506 Te\n0.340053 0.139858 0.640143 Te\n0.633961 0.003609 0.090494 Te\n0.866039 0.003609 0.590494 Te\n0.159947 0.139858 0.140143 Te\n0.911936 0.154098 0.463027 O\n0.689589 0.828267 0.517257 O\n0.088064 0.845902 0.536973 O\n0.645624 0.577322 0.359267 O\n0.854376 0.577322 0.859267 O\n0.355332 0.187847 0.800713 O\n0.670796 0.188173 0.628525 O\n0.329204 0.811827 0.371475 O\n0.053205 0.172949 0.660284 O\n0.644668 0.812153 0.199287 O\n0.553205 0.827051 0.839716 O\n0.446795 0.172949 0.160284 O\n0.855332 0.812153 0.699287 O\n0.145624 0.422678 0.140733 O\n0.411936 0.845902 0.036973 O\n0.189589 0.171733 0.982743 O\n0.810411 0.828267 0.017257 O\n0.829204 0.188173 0.128525 O\n0.946795 0.827051 0.339716 O\n0.144668 0.187847 0.300713 O\n0.310411 0.171733 0.482743 O\n0.354376 0.422678 0.640733 O\n0.170796 0.811827 0.871475 O\n0.588064 0.154098 0.963027 O\n",
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{
"id": "mp-1173844",
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"structure_string": "Na7 La7 Th2 Ti18 O54\n1.0\n0.000000 3.868736 35.540784\n3.868358 0.000000 35.540784\n3.868358 3.868736 0.000000\nNa La Th Ti O\n7 7 2 18 54\ndirect\n0.029418 0.029418 0.970582 Na\n0.138666 0.138666 0.861334 Na\n0.694045 0.694045 0.305955 Na\n0.249765 0.249765 0.750235 Na\n0.805199 0.805199 0.194801 Na\n0.415422 0.415422 0.584578 Na\n0.972708 0.972708 0.027292 Na\n0.529984 0.529984 0.470016 La\n0.084029 0.084029 0.915971 La\n0.638326 0.638326 0.361674 La\n0.194277 0.194277 0.805723 La\n0.749781 0.749781 0.250219 La\n0.305793 0.305793 0.694207 La\n0.859421 0.859421 0.140579 La\n0.915127 0.915127 0.084873 Th\n0.473064 0.473064 0.526936 Th\n0.057098 0.057098 0.442902 Ti\n0.611120 0.611120 0.888880 Ti\n0.557098 0.557098 0.942902 Ti\n0.166358 0.166358 0.333642 Ti\n0.111120 0.111120 0.388880 Ti\n0.721859 0.721859 0.778141 Ti\n0.666358 0.666358 0.833642 Ti\n0.277384 0.277384 0.222616 Ti\n0.221859 0.221859 0.278141 Ti\n0.832716 0.832716 0.667284 Ti\n0.777384 0.777384 0.722616 Ti\n0.387453 0.387453 0.112547 Ti\n0.332716 0.332716 0.167284 Ti\n0.944211 0.944211 0.555789 Ti\n0.887453 0.887453 0.612547 Ti\n0.500811 0.500811 0.999189 Ti\n0.444211 0.444211 0.055789 Ti\n0.000811 0.000811 0.499189 Ti\n0.026917 0.026917 0.473083 O\n0.841561 0.268818 0.731182 O\n0.774101 0.334022 0.225899 O\n0.583330 0.583330 0.916670 O\n0.526917 0.526917 0.973083 O\n0.399510 0.825499 0.174501 O\n0.334022 0.774101 0.665978 O\n0.316264 0.905088 0.683736 O\n0.268818 0.841561 0.158439 O\n0.139078 0.139078 0.360922 O\n0.083330 0.083330 0.416670 O\n0.964673 0.370278 0.629722 O\n0.905088 0.316264 0.094912 O\n0.868524 0.463600 0.131476 O\n0.825499 0.399510 0.600490 O\n0.694575 0.694575 0.805425 O\n0.639078 0.639078 0.860922 O\n0.519519 0.926353 0.073647 O\n0.463600 0.868524 0.536400 O\n0.424836 0.018647 0.575164 O\n0.370278 0.964673 0.035327 O\n0.250116 0.250116 0.249884 O\n0.194575 0.194575 0.305425 O\n0.076659 0.480673 0.519327 O\n0.018647 0.424836 0.981353 O\n0.979277 0.575161 0.020723 O\n0.926353 0.519519 0.480481 O\n0.805602 0.805602 0.694398 O\n0.750116 0.750116 0.749884 O\n0.625508 0.042091 0.957909 O\n0.575161 0.979277 0.424839 O\n0.548014 0.117047 0.451986 O\n0.480673 0.076659 0.923341 O\n0.361608 0.361608 0.138392 O\n0.305602 0.305602 0.194398 O\n0.152907 0.629921 0.370079 O\n0.117047 0.548014 0.882953 O\n0.096696 0.683653 0.903304 O\n0.042091 0.625508 0.374492 O\n0.917456 0.917456 0.582544 O\n0.861608 0.861608 0.638392 O\n0.758877 0.127324 0.872676 O\n0.683653 0.096696 0.316347 O\n0.630039 0.262029 0.369961 O\n0.629921 0.152907 0.847093 O\n0.471664 0.471664 0.028336 O\n0.417456 0.417456 0.082544 O\n0.302111 0.695486 0.304514 O\n0.262029 0.630039 0.737971 O\n0.220806 0.775882 0.779194 O\n0.127324 0.758877 0.241123 O\n0.971664 0.971664 0.528336 O\n0.775882 0.220806 0.224118 O\n0.695486 0.302111 0.697889 O\n",
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"formula_full": "Na7 La7 Th2 Ti18 O54",
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"updated_at": "2021-11-28T01:34:37.788000Z",
"spacegroup": 42
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{
"id": "mp-569120",
"created_at": "2022-09-04T14:39:07.409159Z",
"structure_string": "Nd1 Pt3\n1.0\n4.208141 0.000000 0.000000\n0.000000 4.208141 0.000000\n0.000000 0.000000 4.208141\nNd Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
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{
"id": "mp-756286",
"created_at": "2022-09-04T14:39:07.410738Z",
"structure_string": "La3 Ce4 O12\n1.0\n1.927053 14.299639 0.000000\n-1.927053 14.299639 0.000000\n0.000000 1.065238 5.529730\nLa Ce O\n3 4 12\ndirect\n0.000000 0.000000 0.000000 La\n0.427051 0.427051 0.526087 La\n0.572949 0.572949 0.473913 La\n0.151696 0.151696 0.835698 Ce\n0.285888 0.285888 0.714484 Ce\n0.848304 0.848304 0.164302 Ce\n0.714112 0.714112 0.285516 Ce\n0.635917 0.635917 0.107484 O\n0.513207 0.513207 0.238193 O\n0.350204 0.350204 0.396765 O\n0.216480 0.216480 0.528500 O\n0.649796 0.649796 0.603235 O\n0.074687 0.074687 0.707840 O\n0.925313 0.925313 0.292160 O\n0.486793 0.486793 0.761807 O\n0.783520 0.783520 0.471500 O\n0.213993 0.213993 0.030931 O\n0.786007 0.786007 0.969069 O\n0.364083 0.364083 0.892516 O\n",
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"formula_full": "La3 Ce4 O12",
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{
"id": "mp-1100681",
"created_at": "2022-09-04T14:39:07.412816Z",
"structure_string": "Li9 Mn2 Co5 O16\n1.0\n2.879063 5.187253 0.000000\n-2.879063 5.187253 0.000000\n0.000000 3.819893 9.613068\nLi Mn Co O\n9 2 5 16\ndirect\n0.504908 0.504908 0.995187 Li\n0.007102 0.007102 0.991797 Li\n0.747562 0.247211 0.260017 Li\n0.247211 0.747562 0.260017 Li\n0.997790 0.997790 0.505121 Li\n0.497417 0.497417 0.509292 Li\n0.251889 0.747897 0.736484 Li\n0.747897 0.251889 0.736484 Li\n0.249992 0.249992 0.746924 Li\n0.999875 0.500832 0.996965 Mn\n0.500832 0.999875 0.996965 Mn\n0.248207 0.248207 0.258339 Co\n0.748757 0.748757 0.251075 Co\n0.501712 0.001310 0.507491 Co\n0.001310 0.501712 0.507491 Co\n0.752299 0.752299 0.749471 Co\n0.367046 0.367046 0.893704 O\n0.870339 0.870339 0.891304 O\n0.608138 0.097429 0.127651 O\n0.097429 0.608138 0.127651 O\n0.863947 0.863947 0.379705 O\n0.367393 0.367393 0.372131 O\n0.095736 0.628407 0.627744 O\n0.628407 0.095736 0.627744 O\n0.635493 0.635493 0.110543 O\n0.135182 0.135182 0.109645 O\n0.878660 0.393498 0.364264 O\n0.393498 0.878660 0.364264 O\n0.133077 0.133077 0.611628 O\n0.625470 0.625470 0.625247 O\n0.409186 0.886239 0.878827 O\n0.886239 0.409186 0.878827 O\n",
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"formula_full": "Li9 Mn2 Co5 O16",
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{
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{
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"structure_string": "Mg14 Zr1 Ga1\n1.0\n6.364392 -0.000000 0.000000\n-3.182196 5.511725 0.000000\n0.000000 0.000000 10.133289\nMg Zr Ga\n14 1 1\ndirect\n0.171709 0.835854 0.125000 Mg\n0.164928 0.832464 0.625000 Mg\n0.664146 0.328291 0.125000 Mg\n0.667536 0.335072 0.625000 Mg\n0.664146 0.835854 0.125000 Mg\n0.667536 0.832464 0.625000 Mg\n0.329071 0.170929 0.375849 Mg\n0.329071 0.170929 0.874151 Mg\n0.329071 0.658142 0.375849 Mg\n0.329071 0.658142 0.874151 Mg\n0.841858 0.170929 0.375849 Mg\n0.841858 0.170929 0.874151 Mg\n0.833333 0.666667 0.369768 Mg\n0.833333 0.666667 0.880232 Mg\n0.166667 0.333333 0.125000 Zr\n0.166667 0.333333 0.625000 Ga\n",
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"volume": 355.46340026898,
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"formula_full": "Mg14 Zr1 Ga1",
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{
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"structure_string": "Y3 Fe9 B12 O36\n1.0\n4.808135 -8.327935 0.000000\n4.808135 8.327935 0.000000\n0.000000 0.000000 7.657403\nY Fe B O\n3 9 12 36\ndirect\n0.664353 0.000000 0.333333 Y\n0.000000 0.664353 0.666667 Y\n0.335647 0.335647 0.000000 Y\n0.115444 0.000000 0.333333 Fe\n0.000000 0.115444 0.666667 Fe\n0.884556 0.884556 0.000000 Fe\n0.548606 0.211737 0.654953 Fe\n0.788263 0.336868 0.988286 Fe\n0.211737 0.548606 0.345047 Fe\n0.663132 0.451394 0.321619 Fe\n0.336868 0.788263 0.011714 Fe\n0.451394 0.663132 0.678381 Fe\n0.221527 0.000000 0.833333 B\n0.000000 0.221527 0.166667 B\n0.778473 0.778473 0.500000 B\n0.667647 0.000000 0.833333 B\n0.000000 0.667647 0.166667 B\n0.332353 0.332353 0.500000 B\n0.126077 0.448698 0.849561 B\n0.551302 0.677379 0.182894 B\n0.448698 0.126077 0.150439 B\n0.322621 0.873923 0.516228 B\n0.677379 0.551302 0.817106 B\n0.873923 0.322621 0.483772 B\n0.361103 0.146903 0.813764 O\n0.853097 0.214200 0.147098 O\n0.146903 0.361103 0.186236 O\n0.785800 0.638897 0.480431 O\n0.214200 0.853097 0.852902 O\n0.638897 0.785800 0.519569 O\n0.277750 0.580785 0.875302 O\n0.419215 0.696965 0.208636 O\n0.580785 0.277750 0.124698 O\n0.303035 0.722250 0.541969 O\n0.696965 0.419215 0.791364 O\n0.722250 0.303035 0.458031 O\n0.473668 0.006530 0.519408 O\n0.993470 0.467137 0.852741 O\n0.006530 0.473668 0.480592 O\n0.532863 0.526332 0.186075 O\n0.467137 0.993470 0.147259 O\n0.526332 0.532863 0.813925 O\n0.077777 0.000000 0.833333 O\n0.000000 0.077777 0.166667 O\n0.922223 0.922223 0.500000 O\n0.123445 0.305324 0.822865 O\n0.694676 0.818121 0.156198 O\n0.305324 0.123445 0.177135 O\n0.181879 0.876555 0.489531 O\n0.818121 0.694676 0.843802 O\n0.876555 0.181879 0.510469 O\n0.329872 0.474705 0.509450 O\n0.525295 0.855168 0.842783 O\n0.474705 0.329872 0.490550 O\n0.144832 0.670128 0.176117 O\n0.855168 0.525295 0.157217 O\n0.670128 0.144832 0.823883 O\n0.811449 0.000000 0.833333 O\n0.000000 0.811449 0.166667 O\n0.188551 0.188551 0.500000 O\n",
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}