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{
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{
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{
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"structure_string": "U1 Mo12 O60\n1.0\n8.244958 -6.728627 0.000000\n8.244958 6.728627 0.000000\n2.753794 0.000000 10.279609\nU Mo O\n1 12 60\ndirect\n0.000000 0.000000 0.000000 U\n0.148359 0.667338 0.060881 Mo\n0.667338 0.060881 0.148359 Mo\n0.060881 0.148359 0.667338 Mo\n0.851641 0.332662 0.939119 Mo\n0.332662 0.939119 0.851641 Mo\n0.939119 0.851641 0.332662 Mo\n0.834112 0.724363 0.054905 Mo\n0.724363 0.054905 0.834112 Mo\n0.054905 0.834112 0.724363 Mo\n0.165888 0.275637 0.945095 Mo\n0.275637 0.945095 0.165888 Mo\n0.945095 0.165888 0.275637 Mo\n0.790164 0.674381 0.927707 O\n0.674381 0.927707 0.790164 O\n0.927707 0.790164 0.674381 O\n0.209836 0.325619 0.072293 O\n0.325619 0.072293 0.209836 O\n0.072293 0.209836 0.325619 O\n0.716120 0.683310 0.186034 O\n0.683310 0.186034 0.716120 O\n0.186034 0.716120 0.683310 O\n0.283880 0.316690 0.813966 O\n0.316690 0.813966 0.283880 O\n0.813966 0.283880 0.316690 O\n0.016861 0.791614 0.916705 O\n0.791614 0.916705 0.016861 O\n0.916705 0.016861 0.791614 O\n0.983139 0.208386 0.083295 O\n0.208386 0.083295 0.983139 O\n0.083295 0.983139 0.208386 O\n0.986620 0.583457 0.096112 O\n0.583457 0.096112 0.986620 O\n0.096112 0.986620 0.583457 O\n0.013380 0.416543 0.903888 O\n0.416543 0.903888 0.013380 O\n0.903888 0.013380 0.416543 O\n0.972362 0.805405 0.153760 O\n0.805405 0.153760 0.972362 O\n0.153760 0.972362 0.805405 O\n0.027638 0.194595 0.846240 O\n0.194595 0.846240 0.027638 O\n0.846240 0.027638 0.194595 O\n0.246061 0.595074 0.936807 O\n0.595074 0.936807 0.246061 O\n0.936807 0.246061 0.595074 O\n0.753939 0.404926 0.063193 O\n0.404926 0.063193 0.753939 O\n0.063193 0.753939 0.404926 O\n0.218255 0.598427 0.196711 O\n0.598427 0.196711 0.218255 O\n0.196711 0.218255 0.598427 O\n0.781745 0.401573 0.803289 O\n0.401573 0.803289 0.781745 O\n0.803289 0.781745 0.401573 O\n0.042248 0.524840 0.722602 O\n0.524840 0.722602 0.042248 O\n0.722602 0.042248 0.524840 O\n0.957752 0.475160 0.277398 O\n0.475160 0.277398 0.957752 O\n0.277398 0.957752 0.475160 O\n0.356678 0.263726 0.381278 O\n0.263726 0.381278 0.356678 O\n0.381278 0.356678 0.263726 O\n0.643322 0.736274 0.618722 O\n0.736274 0.618722 0.643322 O\n0.618722 0.643322 0.736274 O\n0.522021 0.606748 0.409602 O\n0.606748 0.409602 0.522021 O\n0.409602 0.522021 0.606748 O\n0.477979 0.393252 0.590398 O\n0.393252 0.590398 0.477979 O\n0.590398 0.477979 0.393252 O\n",
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"formula_full": "U1 Mo12 O60",
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{
"id": "mp-1080279",
"created_at": "2022-09-04T14:43:14.820239Z",
"structure_string": "Ce1 Se2\n1.0\n2.039594 -3.532681 0.000000\n2.039594 3.532681 0.000000\n0.000000 0.000000 12.914028\nCe Se\n1 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333333 0.666667 0.130168 Se\n0.333333 0.666667 0.869832 Se\n",
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{
"id": "mp-1518813",
"created_at": "2022-09-04T14:43:14.760853Z",
"structure_string": "Ba4 Na4 Pr4 Mn4 O24\n1.0\n8.478268 0.000000 0.000000\n0.000000 8.434611 0.000000\n0.000000 0.000000 8.460983\nBa Na Pr Mn O\n4 4 4 4 24\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n-0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.000000 Ba\n0.500000 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n-0.000000 0.500000 0.000000 Na\n-0.000000 0.000000 0.500000 Na\n0.250000 0.250000 0.250000 Pr\n0.750000 0.750000 0.250000 Pr\n0.750000 0.250000 0.750000 Pr\n0.250000 0.750000 0.750000 Pr\n0.750000 0.750000 0.750000 Mn\n0.250000 0.250000 0.750000 Mn\n0.250000 0.750000 0.250000 Mn\n0.750000 0.250000 0.250000 Mn\n0.974581 0.226278 0.273973 O\n0.025419 0.773722 0.273973 O\n0.025419 0.226278 0.726027 O\n0.974581 0.773722 0.726027 O\n0.267935 0.974635 0.222028 O\n0.267935 0.025365 0.777972 O\n0.732065 0.025365 0.222028 O\n0.732065 0.974635 0.777972 O\n0.223986 0.266669 0.974068 O\n0.776014 0.266669 0.025932 O\n0.223986 0.733331 0.025932 O\n0.776014 0.733331 0.974068 O\n0.525419 0.273722 0.226027 O\n0.474581 0.726278 0.226027 O\n0.474581 0.273722 0.773973 O\n0.525419 0.726278 0.773973 O\n0.232065 0.525365 0.277972 O\n0.232065 0.474635 0.722028 O\n0.767935 0.474635 0.277972 O\n0.767935 0.525365 0.722028 O\n0.276014 0.233331 0.525932 O\n0.723986 0.233331 0.474068 O\n0.276014 0.766669 0.474068 O\n0.723986 0.766669 0.525932 O\n",
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{
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"created_at": "2022-09-04T14:43:14.770909Z",
"structure_string": "Ba2 Li1 Sm1 Co1 Cu2 O7\n1.0\n3.830898 0.000000 0.000000\n0.000000 4.110701 0.000000\n0.000000 0.000000 12.797152\nBa Li Sm Co Cu O\n2 1 1 1 2 7\ndirect\n0.500000 0.500000 0.112645 Ba\n0.500000 0.500000 0.797555 Ba\n0.500000 0.000000 0.265231 Li\n0.500000 0.500000 0.509403 Sm\n0.000000 0.000000 0.978102 Co\n0.000000 0.000000 0.399098 Cu\n0.000000 0.000000 0.637948 Cu\n0.500000 0.000000 0.404148 O\n0.500000 0.000000 0.627035 O\n0.000000 0.000000 0.133136 O\n0.000000 0.000000 0.838566 O\n0.000000 0.500000 0.392474 O\n0.000000 0.500000 0.630270 O\n0.000000 0.500000 0.979946 O\n",
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{
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"structure_string": "Cu8 Bi4 Te4 S4 O40\n1.0\n0.000000 -6.105800 0.000000\n-9.416402 0.000000 2.127497\n-0.083831 0.000000 -14.341157\nCu Bi Te S O\n8 4 4 4 40\ndirect\n0.607983 0.245994 0.242791 Cu\n0.892017 0.745994 0.742791 Cu\n0.392017 0.754006 0.757209 Cu\n0.107983 0.254006 0.257209 Cu\n0.484711 0.346560 0.460379 Cu\n0.015289 0.846560 0.960379 Cu\n0.515289 0.653440 0.539621 Cu\n0.984711 0.153440 0.039621 Cu\n0.394639 0.020847 0.375565 Bi\n0.105361 0.520847 0.875565 Bi\n0.605361 0.979153 0.624435 Bi\n0.894639 0.479153 0.124435 Bi\n0.877113 0.922738 0.192530 Te\n0.622887 0.422738 0.692530 Te\n0.122887 0.077262 0.807470 Te\n0.377113 0.577262 0.307470 Te\n0.879509 0.790317 0.416182 S\n0.620491 0.290317 0.916182 S\n0.120491 0.209683 0.583818 S\n0.379509 0.709683 0.083818 S\n0.798987 0.648009 0.418217 O\n0.701013 0.148009 0.918217 O\n0.201013 0.351991 0.581783 O\n0.298987 0.851991 0.081783 O\n0.728839 0.858924 0.354004 O\n0.771161 0.358924 0.854004 O\n0.271161 0.141076 0.645996 O\n0.228839 0.641076 0.145996 O\n0.108830 0.118187 0.485806 O\n0.391170 0.618187 0.985806 O\n0.891170 0.881813 0.514194 O\n0.608830 0.381813 0.014194 O\n0.099718 0.783980 0.369034 O\n0.400282 0.283980 0.869034 O\n0.900282 0.216020 0.630966 O\n0.599718 0.716020 0.130966 O\n0.095447 0.053161 0.257806 O\n0.404553 0.553161 0.757806 O\n0.904553 0.946839 0.742194 O\n0.595447 0.446839 0.242194 O\n0.626723 0.039156 0.235771 O\n0.873277 0.539156 0.735771 O\n0.373277 0.960844 0.764229 O\n0.126723 0.460844 0.264229 O\n0.880448 0.975105 0.067062 O\n0.619552 0.475105 0.567062 O\n0.119552 0.024895 0.932938 O\n0.380448 0.524895 0.432938 O\n0.348074 0.219699 0.174177 O\n0.151926 0.719699 0.674177 O\n0.651926 0.780301 0.825823 O\n0.848074 0.280301 0.325823 O\n0.375444 0.245783 0.349021 O\n0.124556 0.745783 0.849021 O\n0.624556 0.754217 0.650979 O\n0.875444 0.254217 0.150979 O\n0.582086 0.174906 0.480377 O\n0.917914 0.674906 0.980377 O\n0.417914 0.825094 0.519623 O\n0.082086 0.325094 0.019623 O\n",
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{
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"structure_string": "Sm6 Co8 Sn26\n1.0\n9.602176 0.000000 0.000000\n0.000000 9.602176 0.000000\n0.000000 0.000000 9.602176\nSm Co Sn\n6 8 26\ndirect\n0.000000 0.500000 0.750000 Sm\n0.500000 0.250000 0.000000 Sm\n0.750000 0.000000 0.500000 Sm\n0.000000 0.500000 0.250000 Sm\n0.500000 0.750000 0.000000 Sm\n0.250000 0.000000 0.500000 Sm\n0.750000 0.250000 0.750000 Co\n0.250000 0.750000 0.250000 Co\n0.750000 0.750000 0.250000 Co\n0.250000 0.250000 0.750000 Co\n0.250000 0.750000 0.750000 Co\n0.750000 0.250000 0.250000 Co\n0.250000 0.250000 0.250000 Co\n0.750000 0.750000 0.750000 Co\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.803327 0.342599 0.500000 Sn\n0.657401 0.500000 0.803327 Sn\n0.500000 0.196673 0.657401 Sn\n0.196673 0.657401 0.500000 Sn\n0.342599 0.500000 0.196673 Sn\n0.500000 0.803327 0.342599 Sn\n0.803327 0.657401 0.500000 Sn\n0.657401 0.500000 0.196673 Sn\n0.196673 0.342599 0.500000 Sn\n0.342599 0.500000 0.803327 Sn\n0.500000 0.803327 0.657401 Sn\n0.500000 0.196673 0.342599 Sn\n0.303327 0.000000 0.842599 Sn\n0.157401 0.303327 0.000000 Sn\n0.000000 0.157401 0.696673 Sn\n0.696673 0.000000 0.157401 Sn\n0.842599 0.696673 0.000000 Sn\n0.000000 0.842599 0.303327 Sn\n0.303327 0.000000 0.157401 Sn\n0.157401 0.696673 0.000000 Sn\n0.696673 0.000000 0.842599 Sn\n0.842599 0.303327 0.000000 Sn\n0.000000 0.157401 0.303327 Sn\n0.000000 0.842599 0.696673 Sn\n",
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