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{
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{
"id": "oqmd-1102911",
"created_at": "2022-09-04T15:34:46.963271Z",
"updated_at": "2022-09-04T15:34:46.963296Z",
"structure_string": "Ce12 Si12 H12 O48\n1.0\n9.507330 0.000000 0.000000\n-4.753665 8.233589 0.000000\n0.000000 0.000000 13.728895\nCe H O Si\n12 12 48 12\ndirect\n0.751048 0.248951 0.166666 Ce\n0.289482 0.289481 0.166666 Ce\n0.710519 0.710519 0.166666 Ce\n0.248952 0.751048 0.166666 Ce\n0.289481 0.000000 0.499999 Ce\n0.710519 0.000000 0.499999 Ce\n0.248952 0.497903 0.499999 Ce\n0.751049 0.502097 0.499999 Ce\n0.497903 0.248951 0.833333 Ce\n0.000000 0.289481 0.833333 Ce\n0.000000 0.710519 0.833333 Ce\n0.502096 0.751048 0.833333 Ce\n0.500001 0.000000 0.000000 H\n0.000000 0.500001 0.002659 H\n0.000000 0.000000 0.166666 H\n0.500001 0.000000 0.330674 H\n0.000000 0.500001 0.333333 H\n0.500000 0.500001 0.335993 H\n0.000000 0.000000 0.499999 H\n0.000000 0.500001 0.664007 H\n0.500000 0.500001 0.666667 H\n0.500001 0.000000 0.669326 H\n0.000000 0.000000 0.833333 H\n0.500000 0.500001 0.997340 H\n0.029497 0.385244 0.002257 O\n0.970503 0.614756 0.002257 O\n0.710945 0.145008 0.012450 O\n0.289054 0.854992 0.012450 O\n0.165026 0.031667 0.099464 O\n0.834973 0.968332 0.099464 O\n0.732277 0.469604 0.111206 O\n0.267723 0.530396 0.111206 O\n0.530394 0.267723 0.222126 O\n0.469604 0.732277 0.222126 O\n0.031667 0.165026 0.233870 O\n0.968332 0.834974 0.233870 O\n0.854992 0.289055 0.320882 O\n0.145007 0.710944 0.320882 O\n0.385244 0.029497 0.331076 O\n0.614756 0.970503 0.331076 O\n0.385244 0.355748 0.335590 O\n0.614755 0.644252 0.335590 O\n0.145008 0.434063 0.345784 O\n0.854993 0.565938 0.345784 O\n0.968333 0.133359 0.432797 O\n0.031668 0.866641 0.432797 O\n0.530396 0.262673 0.444540 O\n0.469604 0.737327 0.444540 O\n0.732277 0.262673 0.555460 O\n0.267724 0.737327 0.555460 O\n0.165026 0.133359 0.567203 O\n0.834974 0.866641 0.567203 O\n0.289055 0.434063 0.654216 O\n0.710945 0.565938 0.654216 O\n0.970503 0.355748 0.664410 O\n0.029497 0.644252 0.664410 O\n0.644252 0.029497 0.668923 O\n0.355747 0.970503 0.668923 O\n0.434063 0.289055 0.679117 O\n0.565937 0.710944 0.679117 O\n0.133359 0.165026 0.766130 O\n0.866641 0.834974 0.766130 O\n0.737327 0.267723 0.777873 O\n0.262673 0.732277 0.777873 O\n0.737328 0.469604 0.888793 O\n0.262672 0.530396 0.888793 O\n0.866641 0.031667 0.900536 O\n0.133358 0.968332 0.900536 O\n0.434063 0.145008 0.987549 O\n0.565937 0.854992 0.987549 O\n0.355747 0.385244 0.997742 O\n0.644253 0.614756 0.997742 O\n0.242925 0.000000 0.000000 Si\n0.757075 0.000000 0.000000 Si\n0.234338 0.468677 0.000000 Si\n0.765662 0.531324 0.000000 Si\n0.468677 0.234339 0.333333 Si\n0.000000 0.242926 0.333333 Si\n0.000000 0.757074 0.333333 Si\n0.531323 0.765661 0.333333 Si\n0.765663 0.234339 0.666667 Si\n0.242926 0.242926 0.666667 Si\n0.757075 0.757074 0.666667 Si\n0.234338 0.765661 0.666667 Si\n",
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"elements": [
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"formula_full": "Ce12 Si12 H12 O48",
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{
"id": "oqmd-1101072",
"created_at": "2022-09-04T15:34:28.202571Z",
"updated_at": "2022-09-04T15:34:28.202600Z",
"structure_string": "Pm12 Si12 H12 O48\n1.0\n-0.000013 13.061356 0.000003\n0.000006 0.000004 15.874616\n4.398040 -0.000007 0.000002\nH O Pm Si\n12 48 12 12\ndirect\n0.259430 0.414559 0.157632 H\n0.259430 0.085441 0.157632 H\n0.784624 0.750000 0.170793 H\n0.284625 0.750000 0.329240 H\n0.759433 0.414550 0.342343 H\n0.759434 0.085451 0.342343 H\n0.240566 0.585450 0.657657 H\n0.240566 0.914549 0.657658 H\n0.715375 0.250000 0.670762 H\n0.215377 0.250000 0.829208 H\n0.740570 0.914559 0.842369 H\n0.740570 0.585441 0.842370 H\n0.236589 0.250000 0.057399 O\n0.761269 0.567278 0.076738 O\n0.761270 0.932721 0.076740 O\n0.358974 0.750000 0.099563 O\n0.803978 0.382960 0.100756 O\n0.803978 0.117040 0.100759 O\n0.584507 0.833921 0.156229 O\n0.584506 0.666080 0.156230 O\n0.057999 0.166104 0.160101 O\n0.057999 0.333897 0.160103 O\n0.573646 0.992161 0.240862 O\n0.573646 0.507840 0.240863 O\n0.073626 0.507823 0.259151 O\n0.073626 0.992177 0.259153 O\n0.557994 0.333900 0.339889 O\n0.557994 0.166101 0.339889 O\n0.084496 0.833917 0.343750 O\n0.084497 0.666083 0.343750 O\n0.303955 0.382954 0.399146 O\n0.303955 0.117045 0.399147 O\n0.858977 0.750000 0.400448 O\n0.261267 0.932720 0.423170 O\n0.261268 0.567280 0.423170 O\n0.736578 0.250000 0.442569 O\n0.263421 0.750000 0.557428 O\n0.738734 0.067280 0.576830 O\n0.738733 0.432720 0.576831 O\n0.141024 0.250000 0.599551 O\n0.696046 0.882954 0.600850 O\n0.696046 0.617045 0.600853 O\n0.915503 0.333916 0.656249 O\n0.915504 0.166084 0.656249 O\n0.442005 0.666101 0.660110 O\n0.442005 0.833899 0.660112 O\n0.926374 0.492177 0.740848 O\n0.926374 0.007823 0.740849 O\n0.426354 0.007839 0.759137 O\n0.426354 0.492160 0.759139 O\n0.942001 0.666104 0.839897 O\n0.942001 0.833896 0.839899 O\n0.415493 0.166079 0.843770 O\n0.415494 0.333920 0.843772 O\n0.196023 0.882960 0.899241 O\n0.196023 0.617040 0.899244 O\n0.641025 0.250000 0.900439 O\n0.238732 0.432720 0.923259 O\n0.238731 0.067279 0.923260 O\n0.763410 0.750000 0.942603 O\n0.422914 0.595032 0.163255 Pm\n0.422914 0.904968 0.163257 Pm\n0.893202 0.250000 0.183937 Pm\n0.393218 0.250000 0.316042 Pm\n0.922925 0.595033 0.336754 Pm\n0.922926 0.904966 0.336756 Pm\n0.077076 0.095033 0.663243 Pm\n0.077076 0.404966 0.663245 Pm\n0.606781 0.750000 0.683960 Pm\n0.106798 0.750000 0.816063 Pm\n0.577086 0.095032 0.836743 Pm\n0.577085 0.404968 0.836744 Pm\n0.155266 0.586075 0.228458 Si\n0.155266 0.913926 0.228460 Si\n0.126342 0.250000 0.233868 Si\n0.626368 0.250000 0.266109 Si\n0.655213 0.586046 0.271452 Si\n0.655213 0.913954 0.271454 Si\n0.344787 0.086046 0.728548 Si\n0.344787 0.413954 0.728550 Si\n0.373632 0.750000 0.733893 Si\n0.873658 0.750000 0.766129 Si\n0.844733 0.413925 0.771541 Si\n0.844734 0.086074 0.771542 Si\n",
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"elements": [
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{
"id": "oqmd-1101057",
"created_at": "2022-09-04T15:34:27.816297Z",
"updated_at": "2022-09-04T15:34:27.816331Z",
"structure_string": "Dy12 Si12 H12 O48\n1.0\n-0.000163 12.932986 -0.000001\n-0.000003 -0.000001 15.612325\n4.339468 -0.000056 -0.000001\nDy H O Si\n12 12 48 12\ndirect\n0.433283 0.597583 0.152079 Dy\n0.433284 0.902417 0.152079 Dy\n0.888779 0.249999 0.206762 Dy\n0.388793 0.250000 0.293221 Dy\n0.933287 0.597590 0.347931 Dy\n0.933287 0.902410 0.347931 Dy\n0.066712 0.097590 0.652069 Dy\n0.066712 0.402410 0.652069 Dy\n0.611207 0.750000 0.706781 Dy\n0.111221 0.750000 0.793240 Dy\n0.566717 0.097583 0.847920 Dy\n0.566717 0.402417 0.847920 Dy\n0.249930 0.086357 0.128938 H\n0.249931 0.413642 0.128938 H\n0.788193 0.750000 0.175003 H\n0.288192 0.750000 0.325000 H\n0.749927 0.086357 0.371023 H\n0.749927 0.413642 0.371023 H\n0.250073 0.586358 0.628976 H\n0.250073 0.913642 0.628976 H\n0.711807 0.250000 0.675001 H\n0.211806 0.249999 0.824999 H\n0.750069 0.586357 0.871061 H\n0.750069 0.913642 0.871062 H\n0.232634 0.250000 0.056560 O\n0.366600 0.750000 0.099271 O\n0.771523 0.570969 0.105480 O\n0.771523 0.929031 0.105480 O\n0.807870 0.383465 0.126866 O\n0.807870 0.116534 0.126868 O\n0.050988 0.164573 0.156848 O\n0.050988 0.335427 0.156853 O\n0.588449 0.668027 0.163026 O\n0.588449 0.831973 0.163026 O\n0.577097 0.507956 0.223459 O\n0.577097 0.992044 0.223460 O\n0.077073 0.507935 0.276562 O\n0.077073 0.992065 0.276563 O\n0.088442 0.668029 0.336990 O\n0.088443 0.831972 0.336992 O\n0.550981 0.164573 0.343123 O\n0.550981 0.335427 0.343123 O\n0.307862 0.116541 0.372988 O\n0.307862 0.383459 0.372988 O\n0.271517 0.570965 0.394499 O\n0.271517 0.929035 0.394499 O\n0.866604 0.750000 0.400727 O\n0.732616 0.250000 0.443414 O\n0.267383 0.750000 0.556586 O\n0.133395 0.249999 0.599274 O\n0.728482 0.070965 0.605500 O\n0.728483 0.429035 0.605500 O\n0.692137 0.616541 0.627011 O\n0.692137 0.883458 0.627011 O\n0.449020 0.664573 0.656877 O\n0.449020 0.835427 0.656877 O\n0.911558 0.168028 0.663007 O\n0.911558 0.331972 0.663010 O\n0.922926 0.007936 0.723437 O\n0.922926 0.492065 0.723437 O\n0.422903 0.007956 0.776540 O\n0.422903 0.492044 0.776540 O\n0.411550 0.168028 0.836973 O\n0.411551 0.331973 0.836973 O\n0.949013 0.664573 0.843149 O\n0.949013 0.835427 0.843153 O\n0.192129 0.883466 0.873131 O\n0.192129 0.616535 0.873133 O\n0.228476 0.429032 0.894519 O\n0.228477 0.070968 0.894521 O\n0.633400 0.250000 0.900729 O\n0.767366 0.750000 0.943440 O\n0.159311 0.586787 0.215627 Si\n0.159312 0.913214 0.215628 Si\n0.120275 0.250000 0.227528 Si\n0.620310 0.250000 0.272467 Si\n0.659254 0.586752 0.284256 Si\n0.659253 0.913248 0.284256 Si\n0.340747 0.086751 0.715743 Si\n0.340747 0.413249 0.715744 Si\n0.379689 0.750000 0.727532 Si\n0.879724 0.750000 0.772471 Si\n0.840689 0.086787 0.784372 Si\n0.840689 0.413213 0.784372 Si\n",
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"formula_full": "Dy12 Si12 H12 O48",
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{
"id": "oqmd-1101030",
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