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{
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"structure_string": "Na12 V4 B4 P4 O28\n1.0\n0.060635 6.613062 5.323194\n0.061348 -6.614093 5.324486\n8.993981 -0.000473 0.130786\nNa V B P O\n12 4 4 4 28\ndirect\n0.502816 0.252767 0.071572 Na\n0.003566 0.753533 0.071631 Na\n0.496694 0.746575 0.928693 Na\n0.996750 0.246775 0.928743 Na\n0.127825 0.124946 0.251809 Na\n0.627958 0.624911 0.251838 Na\n0.374967 0.877823 0.251776 Na\n0.874960 0.378040 0.251793 Na\n0.625266 0.122307 0.748485 Na\n0.125281 0.622205 0.748106 Na\n0.872574 0.875222 0.748306 Na\n0.372742 0.375222 0.748671 Na\n0.265444 0.515524 0.335813 V\n0.734454 0.484606 0.664172 V\n0.765532 0.015403 0.335867 V\n0.234542 0.984744 0.664079 V\n0.740007 0.989841 0.066091 B\n0.239967 0.489975 0.066104 B\n0.259760 0.009825 0.933862 B\n0.759974 0.510027 0.933934 B\n0.483756 0.233747 0.421391 P\n0.983694 0.733728 0.421276 P\n0.516307 0.766287 0.578550 P\n0.016212 0.266417 0.578526 P\n0.277560 0.027592 0.081457 O\n0.778405 0.528456 0.081389 O\n0.722110 0.971741 0.918540 O\n0.222075 0.472088 0.918534 O\n0.857444 0.107477 0.133920 O\n0.357433 0.607549 0.134038 O\n0.141937 0.892535 0.865960 O\n0.641991 0.392479 0.866604 O\n0.640703 0.890662 0.174678 O\n0.140767 0.390647 0.174627 O\n0.359316 0.108787 0.825349 O\n0.859244 0.608746 0.824930 O\n0.340513 0.090808 0.460614 O\n0.840434 0.590796 0.460466 O\n0.659660 0.909225 0.539495 O\n0.159127 0.409786 0.539512 O\n0.439623 0.689740 0.434569 O\n0.939681 0.189710 0.434529 O\n0.560655 0.310502 0.565226 O\n0.060579 0.810403 0.565132 O\n0.423958 0.361167 0.322950 O\n0.924137 0.861330 0.322817 O\n0.610956 0.173761 0.322855 O\n0.111008 0.673838 0.322736 O\n0.388982 0.826212 0.676973 O\n0.888518 0.325709 0.677040 O\n0.575812 0.638642 0.677021 O\n0.076325 0.139165 0.676952 O\n",
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"spacegroup": 11
},
{
"id": "mp-1184449",
"created_at": "2022-09-04T14:47:07.504917Z",
"structure_string": "Ca1 Mg149\n1.0\n13.843078 -7.992309 0.000000\n0.000000 15.984617 0.000000\n0.000000 0.000000 15.656876\nCa Mg\n1 149\ndirect\n0.000000 0.000000 0.000000 Ca\n0.600147 0.200293 0.000000 Mg\n0.400941 0.200471 0.000000 Mg\n0.799529 0.200471 0.000000 Mg\n0.002493 0.206355 0.000000 Mg\n0.203862 0.206355 0.000000 Mg\n0.600147 0.399853 0.000000 Mg\n0.799707 0.399853 0.000000 Mg\n0.000245 0.401055 0.000000 Mg\n0.400811 0.401056 0.000000 Mg\n0.201567 0.403135 0.000000 Mg\n0.799529 0.599059 0.000000 Mg\n0.000245 0.599189 0.000000 Mg\n0.598945 0.599190 0.000000 Mg\n0.200585 0.600292 0.000000 Mg\n0.399708 0.600293 0.000000 Mg\n0.793645 0.796138 0.000000 Mg\n0.002493 0.796138 0.000000 Mg\n0.596865 0.798433 0.000000 Mg\n0.201567 0.798433 0.000000 Mg\n0.399708 0.799415 0.000000 Mg\n0.793645 0.997506 0.000000 Mg\n0.203862 0.997507 0.000000 Mg\n0.400811 0.999755 0.000000 Mg\n0.598945 0.999755 0.000000 Mg\n0.264252 0.132126 0.165210 Mg\n0.867874 0.132126 0.165210 Mg\n0.867874 0.735748 0.165210 Mg\n0.666666 0.333333 0.166290 Mg\n0.465896 0.133058 0.166573 Mg\n0.667162 0.133058 0.166573 Mg\n0.465896 0.332838 0.166573 Mg\n0.866942 0.332838 0.166573 Mg\n0.667162 0.534104 0.166573 Mg\n0.866942 0.534104 0.166573 Mg\n0.066711 0.533356 0.167352 Mg\n0.466644 0.533356 0.167352 Mg\n0.466644 0.933289 0.167352 Mg\n0.267046 0.534093 0.167368 Mg\n0.465908 0.732954 0.167368 Mg\n0.267046 0.732954 0.167368 Mg\n0.267745 0.335441 0.167734 Mg\n0.067696 0.335442 0.167734 Mg\n0.664559 0.732255 0.167734 Mg\n0.067696 0.732255 0.167734 Mg\n0.267745 0.932305 0.167734 Mg\n0.664559 0.932305 0.167734 Mg\n0.068373 0.136746 0.170771 Mg\n0.863254 0.931627 0.170771 Mg\n0.068373 0.931627 0.170771 Mg\n0.399955 0.199978 0.332902 Mg\n0.800022 0.199979 0.332902 Mg\n0.800022 0.600044 0.332902 Mg\n0.600066 0.200131 0.333038 Mg\n0.799869 0.399934 0.333038 Mg\n0.600066 0.399934 0.333038 Mg\n0.400502 0.000223 0.333797 Mg\n0.599720 0.000223 0.333797 Mg\n0.400502 0.400280 0.333797 Mg\n0.999777 0.400280 0.333797 Mg\n0.999777 0.599497 0.333797 Mg\n0.599720 0.599497 0.333797 Mg\n0.199883 0.599941 0.333813 Mg\n0.400058 0.599941 0.333813 Mg\n0.400058 0.800117 0.333813 Mg\n0.200215 0.400431 0.334018 Mg\n0.599570 0.799785 0.334018 Mg\n0.200215 0.799785 0.334018 Mg\n0.799340 0.000157 0.334008 Mg\n0.200819 0.000158 0.334008 Mg\n0.999842 0.200660 0.334008 Mg\n0.200819 0.200661 0.334008 Mg\n0.999842 0.799181 0.334008 Mg\n0.799340 0.799181 0.334008 Mg\n0.000000 0.000000 0.334249 Mg\n0.066784 0.133568 0.500000 Mg\n0.866410 0.133589 0.500000 Mg\n0.267180 0.133589 0.500000 Mg\n0.466965 0.133962 0.500000 Mg\n0.666997 0.133962 0.500000 Mg\n0.466965 0.333003 0.500000 Mg\n0.866038 0.333003 0.500000 Mg\n0.666666 0.333333 0.500000 Mg\n0.266825 0.333731 0.500000 Mg\n0.066906 0.333731 0.500000 Mg\n0.866038 0.533035 0.500000 Mg\n0.666997 0.533035 0.500000 Mg\n0.066519 0.533259 0.500000 Mg\n0.466740 0.533259 0.500000 Mg\n0.266823 0.533647 0.500000 Mg\n0.866410 0.732820 0.500000 Mg\n0.666270 0.733174 0.500000 Mg\n0.066906 0.733175 0.500000 Mg\n0.466353 0.733176 0.500000 Mg\n0.266823 0.733177 0.500000 Mg\n0.266825 0.933095 0.500000 Mg\n0.666270 0.933095 0.500000 Mg\n0.866432 0.933215 0.500000 Mg\n0.066784 0.933216 0.500000 Mg\n0.466740 0.933481 0.500000 Mg\n0.000000 0.000000 0.665751 Mg\n0.799340 0.000157 0.665992 Mg\n0.200819 0.000158 0.665992 Mg\n0.999842 0.200660 0.665992 Mg\n0.200819 0.200661 0.665992 Mg\n0.999842 0.799181 0.665992 Mg\n0.799340 0.799181 0.665992 Mg\n0.200215 0.400431 0.665982 Mg\n0.599570 0.799785 0.665982 Mg\n0.200215 0.799785 0.665982 Mg\n0.199883 0.599941 0.666187 Mg\n0.400058 0.599941 0.666187 Mg\n0.400058 0.800117 0.666187 Mg\n0.400502 0.000223 0.666203 Mg\n0.599720 0.000223 0.666203 Mg\n0.400502 0.400280 0.666203 Mg\n0.999777 0.400280 0.666203 Mg\n0.999777 0.599497 0.666203 Mg\n0.599720 0.599497 0.666203 Mg\n0.600066 0.200131 0.666962 Mg\n0.799869 0.399934 0.666962 Mg\n0.600066 0.399934 0.666962 Mg\n0.399955 0.199978 0.667097 Mg\n0.800022 0.199979 0.667097 Mg\n0.800022 0.600044 0.667097 Mg\n0.068373 0.136746 0.829229 Mg\n0.863254 0.931627 0.829229 Mg\n0.068373 0.931627 0.829229 Mg\n0.267745 0.335441 0.832266 Mg\n0.067696 0.335442 0.832266 Mg\n0.664559 0.732255 0.832266 Mg\n0.067696 0.732255 0.832266 Mg\n0.267745 0.932305 0.832266 Mg\n0.664559 0.932305 0.832266 Mg\n0.267046 0.534093 0.832632 Mg\n0.465908 0.732954 0.832632 Mg\n0.267046 0.732954 0.832632 Mg\n0.066711 0.533356 0.832648 Mg\n0.466644 0.533356 0.832648 Mg\n0.466644 0.933289 0.832648 Mg\n0.465896 0.133058 0.833428 Mg\n0.667162 0.133058 0.833428 Mg\n0.465896 0.332838 0.833428 Mg\n0.866942 0.332838 0.833428 Mg\n0.667162 0.534104 0.833428 Mg\n0.866942 0.534104 0.833428 Mg\n0.666666 0.333333 0.833710 Mg\n0.264252 0.132126 0.834790 Mg\n0.867874 0.132126 0.834790 Mg\n0.867874 0.735748 0.834790 Mg\n",
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{
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"structure_string": "Pu4 B16 Ru16\n1.0\n-3.726749 3.726749 7.523010\n3.726749 -3.726749 7.523010\n3.726749 3.726749 -7.523010\nPu B Ru\n4 16 16\ndirect\n0.250000 0.250000 0.000000 Pu\n0.750000 0.750000 0.000000 Pu\n0.500000 0.000000 0.500000 Pu\n0.000000 0.500000 0.500000 Pu\n0.224081 0.914683 0.973208 B\n0.724081 0.750874 0.309399 B\n0.164683 0.974081 0.473208 B\n0.664683 0.191475 0.190601 B\n0.525919 0.335317 0.526792 B\n0.025919 0.499126 0.190601 B\n0.585317 0.275919 0.026792 B\n0.085317 0.058525 0.309399 B\n0.441475 0.414683 0.690601 B\n0.941475 0.250874 0.026792 B\n0.000874 0.474081 0.809399 B\n0.500874 0.691475 0.526792 B\n0.308525 0.835317 0.809399 B\n0.808525 0.999126 0.473208 B\n0.749126 0.775919 0.690601 B\n0.249126 0.558525 0.973208 B\n0.537274 0.073219 0.234807 Ru\n0.037274 0.802468 0.464055 Ru\n0.323219 0.287274 0.734807 Ru\n0.823219 0.088413 0.035945 Ru\n0.212726 0.176781 0.265193 Ru\n0.712726 0.447532 0.035945 Ru\n0.426781 0.962726 0.765193 Ru\n0.926781 0.161587 0.464055 Ru\n0.338413 0.573219 0.535945 Ru\n0.838413 0.302468 0.765193 Ru\n0.052468 0.787274 0.964055 Ru\n0.552468 0.588413 0.265193 Ru\n0.411587 0.676781 0.964055 Ru\n0.911587 0.947532 0.734807 Ru\n0.697532 0.462726 0.535945 Ru\n0.197532 0.661587 0.234807 Ru\n",
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{
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"structure_string": "La40 S58 O2\n1.0\n-7.773652 7.773652 10.290447\n7.773652 -7.773652 10.290447\n7.773652 7.773652 -10.290447\nLa S O\n40 58 2\ndirect\n0.888347 0.884283 0.276028 La\n0.046007 0.950112 0.653906 La\n0.835157 0.177636 0.366817 La\n0.108947 0.203763 0.654415 La\n0.531659 0.164843 0.342479 La\n0.050722 0.692346 0.376478 La\n0.927636 0.085157 0.866817 La\n0.822364 0.189181 0.657521 La\n0.607899 0.953993 0.904105 La\n0.549349 0.454533 0.345585 La\n0.200651 0.046237 0.405184 La\n0.115717 0.391745 0.004064 La\n0.634283 0.138347 0.776028 La\n0.861653 0.637681 0.495936 La\n0.325755 0.949278 0.641624 La\n0.810819 0.468341 0.633183 La\n0.939181 0.072364 0.157521 La\n0.545467 0.891053 0.094816 La\n0.453794 0.299888 0.595895 La\n0.296206 0.392101 0.346094 La\n0.796237 0.450651 0.905184 La\n0.703993 0.857899 0.404105 La\n0.953763 0.358947 0.154415 La\n0.307654 0.684131 0.358376 La\n0.914843 0.781659 0.842479 La\n0.442346 0.300722 0.876478 La\n0.387681 0.111653 0.995936 La\n0.608255 0.612319 0.723972 La\n0.141745 0.365717 0.504064 La\n0.049888 0.703794 0.095895 La\n0.641053 0.795467 0.594816 La\n0.700112 0.296007 0.153906 La\n0.218341 0.060819 0.133183 La\n0.315869 0.674245 0.623522 La\n0.434131 0.557654 0.858376 La\n0.699278 0.575755 0.141624 La\n0.142101 0.546206 0.846094 La\n0.424245 0.565869 0.123522 La\n0.204533 0.799349 0.845585 La\n0.362319 0.858255 0.223972 La\n0.107220 0.937926 0.482843 S\n0.028644 0.125000 0.403644 S\n0.919093 0.279504 0.288024 S\n0.876799 0.042968 0.483966 S\n0.588384 0.981321 0.332952 S\n0.029504 0.169093 0.788025 S\n0.720496 0.008520 0.639589 S\n0.868756 0.511249 0.284461 S\n0.018679 0.351631 0.607063 S\n0.750000 0.250000 0.500000 S\n0.000000 0.000000 0.000000 S\n0.005431 0.898369 0.167048 S\n0.513005 0.906256 0.661362 S\n0.744569 0.411616 0.392937 S\n0.368931 0.080907 0.360411 S\n0.101631 0.268679 0.107063 S\n0.648369 0.255431 0.667048 S\n0.093744 0.755106 0.606749 S\n0.875000 0.278644 0.903644 S\n0.875000 0.775065 0.400065 S\n0.642780 0.625624 0.330706 S\n0.792968 0.126799 0.983966 S\n0.957032 0.440999 0.833831 S\n0.375624 0.892780 0.830706 S\n0.190999 0.207032 0.333831 S\n0.559001 0.392832 0.516034 S\n0.991480 0.631069 0.711975 S\n0.758520 0.970496 0.139589 S\n0.415705 0.131244 0.642493 S\n0.525065 0.125000 0.900065 S\n0.721356 0.625000 0.596356 S\n0.261249 0.118756 0.784461 S\n0.830907 0.618931 0.860411 S\n0.488751 0.773212 0.357507 S\n0.687926 0.357220 0.982843 S\n0.062074 0.544917 0.169294 S\n0.873201 0.857168 0.666169 S\n0.607168 0.123201 0.166169 S\n0.455083 0.624376 0.517157 S\n0.294917 0.312074 0.669294 S\n0.375000 0.474935 0.599935 S\n0.375000 0.971356 0.096356 S\n0.601643 0.494894 0.838638 S\n0.148357 0.486995 0.393251 S\n0.161616 0.994569 0.892937 S\n0.881244 0.665705 0.142493 S\n0.505106 0.343744 0.106749 S\n0.731321 0.838384 0.832952 S\n0.244894 0.851643 0.338638 S\n0.236995 0.398357 0.893251 S\n0.381069 0.241480 0.211975 S\n0.226788 0.584295 0.715539 S\n0.523212 0.738751 0.857507 S\n0.656256 0.763005 0.161362 S\n0.374376 0.705083 0.017157 S\n0.334295 0.476788 0.215539 S\n0.224935 0.625000 0.099935 S\n0.142832 0.809001 0.016034 S\n0.250000 0.750000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
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{
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