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{
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{
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"structure_string": "Mn2 Cr2 Si4\n1.0\n4.560709 0.000000 0.000000\n0.000000 4.543461 0.000000\n0.000000 0.061552 4.554107\nMn Cr Si\n2 2 4\ndirect\n0.362161 0.859434 0.384732 Mn\n0.862161 0.140566 0.615268 Mn\n0.637222 0.634954 0.890151 Cr\n0.137222 0.365046 0.109849 Cr\n0.347581 0.340737 0.595681 Si\n0.847581 0.659263 0.404319 Si\n0.653037 0.149257 0.100275 Si\n0.153037 0.850743 0.899725 Si\n",
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{
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"structure_string": "Rb2 Zn8 B6 O18\n1.0\n5.062289 0.000000 0.000000\n0.000000 6.979935 0.000000\n0.000000 0.694801 12.900937\nRb Zn B O\n2 8 6 18\ndirect\n0.276331 0.000000 0.750000 Rb\n0.723669 0.000000 0.250000 Rb\n0.350069 0.488456 0.875370 Zn\n0.350069 0.511544 0.624630 Zn\n0.649931 0.511544 0.124630 Zn\n0.649931 0.488456 0.375370 Zn\n0.832875 0.208504 0.939198 Zn\n0.832875 0.791496 0.560802 Zn\n0.167125 0.791496 0.060802 Zn\n0.167125 0.208504 0.439198 Zn\n0.845106 0.500000 0.750000 B\n0.154894 0.500000 0.250000 B\n0.654823 0.190068 0.546003 B\n0.654823 0.809932 0.953997 B\n0.345177 0.809932 0.453997 B\n0.345177 0.190068 0.046003 B\n0.120577 0.500000 0.750000 O\n0.879423 0.500000 0.250000 O\n0.202535 0.275010 0.962798 O\n0.202535 0.724990 0.537202 O\n0.797465 0.724990 0.037202 O\n0.797465 0.275010 0.462798 O\n0.707823 0.406335 0.830361 O\n0.707823 0.593665 0.669639 O\n0.292177 0.593665 0.169639 O\n0.292177 0.406335 0.330361 O\n0.397406 0.263277 0.561793 O\n0.397406 0.736723 0.938207 O\n0.602594 0.736723 0.438207 O\n0.602594 0.263277 0.061793 O\n0.752066 0.043270 0.607397 O\n0.752066 0.956730 0.892603 O\n0.247934 0.956730 0.392603 O\n0.247934 0.043270 0.107397 O\n",
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{
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{
"id": "mp-1215873",
"created_at": "2022-09-04T14:44:14.878015Z",
"structure_string": "Zr2 Ti1 Pb3 O9\n1.0\n2.926412 -5.068693 0.000000\n2.926412 5.068693 0.000000\n0.000000 0.000000 7.291130\nZr Ti Pb O\n2 1 3 9\ndirect\n0.666667 0.333333 0.679656 Zr\n0.000000 0.000000 0.024092 Zr\n0.333333 0.666667 0.355054 Ti\n0.333333 0.666667 0.906584 Pb\n0.666667 0.333333 0.224441 Pb\n0.000000 0.000000 0.557731 Pb\n0.499607 0.999214 0.476979 O\n0.840693 0.681387 0.818398 O\n0.177188 0.354377 0.160580 O\n0.499607 0.500393 0.476979 O\n0.840693 0.159307 0.818398 O\n0.177188 0.822812 0.160580 O\n0.000786 0.500393 0.476979 O\n0.318613 0.159307 0.818398 O\n0.645623 0.822812 0.160580 O\n",
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"formula_full": "Zr2 Ti1 Pb3 O9",
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{
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{
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{
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"structure_string": "Hg12 S8 Br8\n1.0\n4.766974 9.344686 0.000000\n-4.766974 9.344686 0.000000\n0.000000 4.671733 9.534796\nHg S Br\n12 8 8\ndirect\n0.339377 0.806092 0.705949 Hg\n0.193908 0.660623 0.294051 Hg\n0.660623 0.193908 0.294051 Hg\n0.806092 0.339377 0.705949 Hg\n0.393514 0.867247 0.995878 Hg\n0.132753 0.606486 0.004122 Hg\n0.606486 0.132753 0.004122 Hg\n0.867247 0.393514 0.995878 Hg\n0.784195 0.784195 0.284090 Hg\n0.215805 0.215805 0.715910 Hg\n0.925012 0.925012 0.728428 Hg\n0.074988 0.074988 0.271572 Hg\n0.322890 0.812785 0.251109 S\n0.187215 0.677110 0.748891 S\n0.677110 0.187215 0.748891 S\n0.812785 0.322890 0.251109 S\n0.449281 0.939712 0.740522 S\n0.060288 0.550719 0.259478 S\n0.550719 0.060288 0.259478 S\n0.939712 0.449281 0.740522 S\n0.249814 0.249814 0.996503 Br\n0.750186 0.750186 0.003497 Br\n0.882449 0.882449 0.486286 Br\n0.117551 0.117551 0.513714 Br\n0.000000 0.000000 0.000000 Br\n0.500000 0.500000 0.000000 Br\n0.619064 0.619064 0.504194 Br\n0.380936 0.380936 0.495806 Br\n",
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{
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"structure_string": "K22 Nb13 In11 P24 O120\n1.0\n9.484528 -0.013158 0.008530\n-0.013153 9.461978 0.010032\n0.028368 0.032382 33.253121\nK Nb In P O\n22 13 11 24 120\ndirect\n0.001220 0.218320 0.156555 K\n0.004582 0.225741 0.490572 K\n0.004770 0.225799 0.823883 K\n0.225709 0.995655 0.407411 K\n0.225940 0.995396 0.740579 K\n0.271455 0.515118 0.240328 K\n0.274025 0.516143 0.573646 K\n0.273978 0.516541 0.907054 K\n0.485708 0.274343 0.323485 K\n0.483735 0.274151 0.656921 K\n0.480484 0.272933 0.989875 K\n0.518093 0.726218 0.156444 K\n0.516425 0.726100 0.490273 K\n0.516114 0.725941 0.823681 K\n0.727053 0.485673 0.073405 K\n0.725984 0.483694 0.406813 K\n0.726006 0.483706 0.740314 K\n0.774077 0.004622 0.573863 K\n0.773965 0.004055 0.906986 K\n0.992507 0.777971 0.322362 K\n0.995266 0.774200 0.657226 K\n0.999339 0.779617 0.991626 K\n0.104691 0.386282 0.008399 Nb\n0.102593 0.385257 0.341221 Nb\n0.104009 0.385935 0.674697 Nb\n0.374399 0.135645 0.173651 Nb\n0.382654 0.889880 0.259716 Nb\n0.386033 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}