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{
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"structure_string": "Na4 Ca8 Mg8 V12 O48\n1.0\n-6.286631 6.286631 6.293984\n6.286631 -6.286631 6.293984\n6.286631 6.286631 -6.293984\nNa Ca Mg V O\n4 8 8 12 48\ndirect\n0.000000 0.500000 0.500000 Na\n0.250000 0.250000 0.000000 Na\n0.500000 0.000000 0.500000 Na\n0.750000 0.750000 0.000000 Na\n0.125000 0.998074 0.373074 Ca\n0.001926 0.375000 0.126926 Ca\n0.501926 0.375000 0.626926 Ca\n0.125000 0.498074 0.873074 Ca\n0.248074 0.875000 0.873074 Ca\n0.625000 0.751926 0.626926 Ca\n0.748074 0.875000 0.373074 Ca\n0.625000 0.251926 0.126926 Ca\n0.875000 0.625000 0.250000 Mg\n0.875000 0.625000 0.750000 Mg\n0.375000 0.125000 0.750000 Mg\n0.375000 0.625000 0.750000 Mg\n0.375000 0.625000 0.250000 Mg\n0.375000 0.125000 0.250000 Mg\n0.875000 0.125000 0.250000 Mg\n0.875000 0.125000 0.750000 Mg\n0.000000 0.000000 0.000000 V\n0.999510 0.875000 0.624510 V\n0.250490 0.375000 0.375490 V\n0.125000 0.749510 0.124510 V\n0.125000 0.249510 0.624510 V\n0.250000 0.750000 0.500000 V\n0.500000 0.500000 0.000000 V\n0.625000 0.500490 0.375490 V\n0.499510 0.875000 0.124510 V\n0.625000 0.000490 0.875490 V\n0.750490 0.375000 0.875490 V\n0.750000 0.250000 0.500000 V\n0.981595 0.742123 0.163137 O\n0.988409 0.138932 0.957848 O\n0.891567 0.331938 0.870160 O\n0.969439 0.011591 0.150523 O\n0.961778 0.831938 0.440371 O\n0.978593 0.108433 0.440371 O\n0.068458 0.328986 0.336863 O\n0.288222 0.228593 0.370160 O\n0.257877 0.421014 0.239472 O\n0.168062 0.608433 0.129840 O\n0.181542 0.018405 0.760528 O\n0.888932 0.431084 0.650523 O\n0.068916 0.611068 0.349477 O\n0.078986 0.242123 0.760528 O\n0.271407 0.211778 0.629840 O\n0.181084 0.030561 0.042152 O\n0.171014 0.431542 0.663137 O\n0.992123 0.731595 0.663137 O\n0.268405 0.931542 0.260528 O\n0.391567 0.521407 0.559629 O\n0.388932 0.738409 0.457848 O\n0.261591 0.719439 0.650523 O\n0.469439 0.318916 0.957848 O\n0.081938 0.711778 0.940371 O\n0.668062 0.538222 0.559629 O\n0.280561 0.931084 0.542152 O\n0.488409 0.530561 0.849477 O\n0.361068 0.511591 0.042152 O\n0.358433 0.728593 0.940371 O\n0.481595 0.318458 0.239472 O\n0.757877 0.518405 0.836863 O\n0.578986 0.818458 0.836863 O\n0.568916 0.219439 0.457848 O\n0.478593 0.038222 0.870160 O\n0.671014 0.007877 0.739472 O\n0.681084 0.638932 0.150523 O\n0.861068 0.818916 0.849477 O\n0.568458 0.231595 0.739472 O\n0.492123 0.828986 0.260528 O\n0.581938 0.641567 0.370160 O\n0.461778 0.021407 0.129840 O\n0.681542 0.921014 0.163137 O\n0.771407 0.141567 0.059629 O\n0.788222 0.418062 0.059629 O\n0.780561 0.238409 0.349477 O\n0.858433 0.918062 0.629840 O\n0.761591 0.111068 0.542152 O\n0.768405 0.507877 0.336863 O\n",
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"formula_full": "Na4 Ca8 Mg8 V12 O48",
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{
"id": "mp-1214380",
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"structure_string": "Ba2 Li2 Gd4 Mo8 O32\n1.0\n6.418337 2.659904 0.000000\n-6.418337 2.659904 0.000000\n0.000000 0.450469 19.473656\nBa Li Gd Mo O\n2 2 4 8 32\ndirect\n0.528497 0.471503 0.750000 Ba\n0.471503 0.528497 0.250000 Ba\n0.818215 0.181785 0.750000 Li\n0.181785 0.818215 0.250000 Li\n0.644261 0.355565 0.532204 Gd\n0.355739 0.644435 0.467796 Gd\n0.644435 0.355739 0.967796 Gd\n0.355565 0.644261 0.032204 Gd\n0.237951 0.759605 0.650017 Mo\n0.762049 0.240395 0.349983 Mo\n0.240395 0.762049 0.849983 Mo\n0.759605 0.237951 0.150017 Mo\n0.929761 0.050838 0.593032 Mo\n0.070239 0.949162 0.406968 Mo\n0.949162 0.070239 0.906968 Mo\n0.050838 0.929761 0.093032 Mo\n0.429242 0.029976 0.786618 O\n0.570758 0.970024 0.213382 O\n0.970024 0.570758 0.713382 O\n0.029976 0.429242 0.286618 O\n0.785590 0.955532 0.825467 O\n0.214410 0.044468 0.174533 O\n0.044468 0.214410 0.674533 O\n0.955532 0.785590 0.325467 O\n0.720559 0.757003 0.964101 O\n0.279441 0.242997 0.035899 O\n0.242997 0.279441 0.535899 O\n0.757003 0.720559 0.464101 O\n0.497673 0.788333 0.679950 O\n0.502327 0.211667 0.320050 O\n0.211667 0.502327 0.820050 O\n0.788333 0.497673 0.179950 O\n0.399712 0.106915 0.636372 O\n0.600288 0.893085 0.363628 O\n0.893085 0.600288 0.863628 O\n0.106915 0.399712 0.136372 O\n0.714832 0.803617 0.105364 O\n0.285168 0.196383 0.894636 O\n0.196383 0.285168 0.394636 O\n0.803617 0.714832 0.605364 O\n0.669943 0.011265 0.545018 O\n0.330057 0.988735 0.454982 O\n0.988735 0.330057 0.954982 O\n0.011265 0.669943 0.045018 O\n0.424225 0.903686 0.931645 O\n0.575775 0.096314 0.068355 O\n0.096314 0.575775 0.568355 O\n0.903686 0.424225 0.431645 O\n",
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"formula_full": "Ba2 Li2 Gd4 Mo8 O32",
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{
"id": "mp-695951",
"created_at": "2022-09-04T14:41:56.455540Z",
"structure_string": "Li2 Ag4 P6 H4 O20\n1.0\n7.727536 0.000000 0.000000\n2.288061 7.385178 0.000000\n2.402526 1.885976 7.947965\nLi Ag P H O\n2 4 6 4 20\ndirect\n0.081250 0.295565 0.335302 Li\n0.918750 0.704435 0.664698 Li\n0.339404 0.561777 0.404034 Ag\n0.660596 0.438223 0.595966 Ag\n0.417461 0.304318 0.985095 Ag\n0.582539 0.695682 0.014905 Ag\n0.735673 0.238634 0.267687 P\n0.264327 0.761366 0.732313 P\n0.099907 0.713287 0.094097 P\n0.900093 0.286713 0.905903 P\n0.738666 0.824560 0.326422 P\n0.261334 0.175440 0.673578 P\n0.775197 0.989531 0.822531 H\n0.224803 0.010469 0.177469 H\n0.349606 0.005306 0.292804 H\n0.650394 0.994694 0.707196 H\n0.824238 0.260635 0.395305 O\n0.175762 0.739365 0.604695 O\n0.569169 0.384856 0.216703 O\n0.430831 0.615144 0.783297 O\n0.677258 0.042457 0.331075 O\n0.322742 0.957543 0.668925 O\n0.899550 0.214888 0.104924 O\n0.100450 0.785112 0.895076 O\n0.570985 0.779785 0.304762 O\n0.429015 0.220215 0.695238 O\n0.827702 0.710802 0.471569 O\n0.172298 0.289198 0.528431 O\n0.890287 0.827463 0.150961 O\n0.109713 0.172537 0.849039 O\n0.235641 0.791660 0.134605 O\n0.764359 0.208340 0.865395 O\n0.116701 0.507051 0.148071 O\n0.883299 0.492949 0.851929 O\n0.743385 0.907773 0.769954 O\n0.256615 0.092227 0.230046 O\n",
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{
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"created_at": "2022-09-04T14:41:49.167121Z",
"structure_string": "Sr2 Eu1 Ta1 Cu2 O8\n1.0\n3.943722 0.000000 0.000000\n0.000000 3.943722 0.000000\n0.000000 0.000000 11.781661\nSr Eu Ta Cu O\n2 1 1 2 8\ndirect\n0.500000 0.500000 0.200232 Sr\n0.500000 0.500000 0.799768 Sr\n0.500000 0.500000 0.500000 Eu\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.355711 Cu\n0.000000 0.000000 0.644289 Cu\n0.000000 0.000000 0.168369 O\n0.000000 0.000000 0.831631 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.367411 O\n0.000000 0.500000 0.632589 O\n0.500000 0.000000 0.367411 O\n0.500000 0.000000 0.632589 O\n",
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{
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{
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"structure_string": "Na4 Cu10 Te2 S6 O38\n1.0\n11.766523 0.000000 0.000000\n0.000000 7.463549 0.000000\n0.000000 3.401674 8.635586\nNa Cu Te S O\n4 10 2 6 38\ndirect\n0.250000 0.981283 0.967211 Na\n0.750000 0.018717 0.032789 Na\n0.500000 0.000000 0.500000 Na\n0.000000 0.000000 0.500000 Na\n0.375757 0.450092 0.786433 Cu\n0.875757 0.549908 0.213567 Cu\n0.624243 0.549908 0.213567 Cu\n0.124243 0.450092 0.786433 Cu\n0.367217 0.509902 0.217367 Cu\n0.867217 0.490098 0.782633 Cu\n0.632783 0.490098 0.782633 Cu\n0.132783 0.509902 0.217367 Cu\n0.500000 0.500000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.250000 0.786924 0.420076 Te\n0.750000 0.213076 0.579924 Te\n0.525685 0.808351 0.887330 S\n0.025685 0.191649 0.112670 S\n0.474315 0.191649 0.112670 S\n0.974315 0.808351 0.887330 S\n0.250000 0.174592 0.571120 S\n0.750000 0.825408 0.428880 S\n0.250000 0.666503 0.257413 O\n0.750000 0.333497 0.742587 O\n0.250000 0.547429 0.839326 O\n0.750000 0.452571 0.160674 O\n0.486479 0.615326 0.288837 O\n0.986479 0.384674 0.711163 O\n0.513521 0.384674 0.711163 O\n0.013521 0.615326 0.288837 O\n0.373466 0.642939 0.547020 O\n0.873466 0.357061 0.452980 O\n0.626534 0.357061 0.452980 O\n0.126534 0.642939 0.547020 O\n0.250000 0.416453 0.142151 O\n0.750000 0.583547 0.857849 O\n0.618181 0.775335 0.005411 O\n0.118181 0.224665 0.994589 O\n0.381819 0.224665 0.994589 O\n0.881819 0.775335 0.005411 O\n0.413701 0.813494 0.953244 O\n0.913701 0.186506 0.046756 O\n0.586299 0.186506 0.046756 O\n0.086299 0.813494 0.953244 O\n0.518725 0.632287 0.837308 O\n0.018725 0.367713 0.162692 O\n0.481275 0.367713 0.162692 O\n0.981275 0.632287 0.837308 O\n0.250000 0.214842 0.716950 O\n0.750000 0.785158 0.283050 O\n0.554168 0.978435 0.751415 O\n0.054168 0.021565 0.248585 O\n0.445832 0.021565 0.248585 O\n0.945832 0.978435 0.751415 O\n0.354840 0.255652 0.480229 O\n0.854840 0.744348 0.519771 O\n0.645160 0.744348 0.519771 O\n0.145160 0.255652 0.480229 O\n0.250000 0.959207 0.610255 O\n0.750000 0.040793 0.389745 O\n",
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{
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}