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{
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"formula_full": "Al4 H44 S4 O40",
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{
"id": "mp-1075372",
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"structure_string": "Mg10 Si12\n1.0\n1.988183 15.251365 0.000000\n-1.988183 15.251365 0.000000\n0.000000 1.507769 6.788057\nMg Si\n10 12\ndirect\n0.277483 0.277483 0.860408 Mg\n0.011297 0.011297 0.009184 Mg\n0.588597 0.588597 0.129013 Mg\n0.434787 0.434787 0.895596 Mg\n0.843899 0.843899 0.994925 Mg\n0.177513 0.177513 0.039833 Mg\n0.549413 0.549413 0.663098 Mg\n0.473799 0.473799 0.352618 Mg\n0.800315 0.800315 0.483913 Mg\n0.217348 0.217348 0.513597 Mg\n0.725325 0.725325 0.793994 Si\n0.292645 0.292645 0.220374 Si\n0.983427 0.983427 0.658498 Si\n0.038611 0.038611 0.360660 Si\n0.660228 0.660228 0.355900 Si\n0.363789 0.363789 0.641636 Si\n0.918123 0.918123 0.199193 Si\n0.103953 0.103953 0.817513 Si\n0.652760 0.652760 0.718704 Si\n0.366719 0.366719 0.280953 Si\n0.911329 0.911329 0.565316 Si\n0.111578 0.111578 0.445076 Si\n",
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{
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{
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{
"id": "mp-1204034",
"created_at": "2022-09-04T14:46:25.244292Z",
"structure_string": "Sb8 C16 S8 Cl24 O8\n1.0\n9.544082 0.000000 0.000000\n0.000000 7.645347 0.000000\n0.000000 0.172167 30.144797\nSb C S Cl O\n8 16 8 24 8\ndirect\n0.178287 0.031788 0.876221 Sb\n0.678287 0.968212 0.623779 Sb\n0.821713 0.968212 0.123779 Sb\n0.321713 0.031788 0.376221 Sb\n0.342249 0.531204 0.886864 Sb\n0.842249 0.468796 0.613136 Sb\n0.657751 0.468796 0.113136 Sb\n0.157751 0.531204 0.386864 Sb\n0.641921 0.827244 0.770645 C\n0.141921 0.172756 0.729355 C\n0.358079 0.172756 0.229355 C\n0.858079 0.827244 0.270645 C\n0.766852 0.812828 0.787058 C\n0.266852 0.187172 0.712942 C\n0.233148 0.187172 0.212942 C\n0.733148 0.812828 0.287058 C\n0.725887 0.299010 0.995193 C\n0.225887 0.700990 0.504807 C\n0.274113 0.700990 0.004807 C\n0.774113 0.299010 0.495193 C\n0.778956 0.212172 0.962449 C\n0.278956 0.787828 0.537551 C\n0.221044 0.787828 0.037551 C\n0.721044 0.212172 0.462449 C\n0.922579 0.892418 0.787219 S\n0.422579 0.107582 0.712781 S\n0.077421 0.107582 0.212781 S\n0.577421 0.892418 0.287219 S\n0.864798 0.223458 0.916906 S\n0.364798 0.776542 0.583094 S\n0.135202 0.776542 0.083094 S\n0.635202 0.223458 0.416906 S\n0.096906 0.300721 0.832747 Cl\n0.596906 0.699279 0.667253 Cl\n0.903094 0.699279 0.167253 Cl\n0.403094 0.300721 0.332747 Cl\n0.107447 0.785518 0.927072 Cl\n0.607447 0.214482 0.572928 Cl\n0.892553 0.214482 0.072928 Cl\n0.392553 0.785518 0.427072 Cl\n0.212422 0.207192 0.942459 Cl\n0.712422 0.792808 0.557541 Cl\n0.787578 0.792808 0.057541 Cl\n0.287578 0.207192 0.442459 Cl\n0.488063 0.308279 0.851491 Cl\n0.988063 0.691721 0.648509 Cl\n0.511937 0.691721 0.148509 Cl\n0.011937 0.308279 0.351491 Cl\n0.360487 0.752000 0.827353 Cl\n0.860487 0.248000 0.672647 Cl\n0.639513 0.248000 0.172647 Cl\n0.139513 0.752000 0.327353 Cl\n0.531022 0.648964 0.928247 Cl\n0.031022 0.351036 0.571753 Cl\n0.468978 0.351036 0.071753 Cl\n0.968978 0.648964 0.428247 Cl\n0.013004 0.829157 0.824144 O\n0.513004 0.170843 0.675856 O\n0.986996 0.170843 0.175856 O\n0.486996 0.829157 0.324144 O\n0.896176 0.050175 0.896269 O\n0.396176 0.949825 0.603731 O\n0.103824 0.949825 0.103731 O\n0.603824 0.050175 0.396269 O\n",
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{
"id": "mp-1029424",
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"structure_string": "Li2 Ti4 N6\n1.0\n6.076109 -0.126849 0.000000\n-3.146570 5.451602 0.000000\n0.000000 0.000000 4.157506\nLi Ti N\n2 4 6\ndirect\n0.000000 0.648134 0.431362 Li\n0.000000 0.351866 0.931362 Li\n0.324182 0.331714 0.431326 Ti\n0.675818 0.007531 0.431326 Ti\n0.675818 0.668286 0.931326 Ti\n0.324182 0.992469 0.931326 Ti\n0.364241 0.329911 0.931325 N\n0.635759 0.965670 0.931325 N\n0.635759 0.670089 0.431325 N\n0.364241 0.034330 0.431325 N\n0.000000 0.699377 0.931335 N\n0.000000 0.300623 0.431335 N\n",
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{
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{
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{
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{
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"structure_string": "Na12 Zn2 O8\n1.0\n3.831752 -6.636789 0.000000\n3.831752 6.636789 0.000000\n0.000000 0.000000 5.916247\nNa Zn O\n12 2 8\ndirect\n0.925192 0.462596 0.135071 Na\n0.462596 0.537404 0.635071 Na\n0.142023 0.857977 0.967510 Na\n0.284046 0.142023 0.467510 Na\n0.857977 0.715954 0.467510 Na\n0.142023 0.284046 0.967510 Na\n0.715954 0.857977 0.967510 Na\n0.857977 0.142023 0.467510 Na\n0.537404 0.462596 0.135071 Na\n0.074808 0.537404 0.635071 Na\n0.462596 0.925192 0.635071 Na\n0.537404 0.074808 0.135071 Na\n0.666667 0.333333 0.742630 Zn\n0.333333 0.666667 0.242630 Zn\n0.188583 0.811417 0.356868 O\n0.377166 0.188583 0.856868 O\n0.333333 0.666667 0.905024 O\n0.666667 0.333333 0.405024 O\n0.811417 0.188583 0.856868 O\n0.622834 0.811417 0.356868 O\n0.188583 0.377166 0.356868 O\n0.811417 0.622834 0.856868 O\n",
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}