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{
"id": "mp-759073",
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"structure_string": "Na5 V12 O32\n1.0\n3.648294 7.476326 0.000000\n-3.648294 7.476326 0.000000\n0.000000 3.779415 11.785450\nNa V O\n5 12 32\ndirect\n0.124884 0.124884 0.681338 Na\n0.625560 0.625560 0.683551 Na\n0.375805 0.872540 0.318911 Na\n0.872540 0.375805 0.318911 Na\n0.090527 0.090527 0.050972 Na\n0.343813 0.343813 0.806155 V\n0.841759 0.841759 0.807840 V\n0.553935 0.053397 0.462001 V\n0.053397 0.553935 0.462001 V\n0.282334 0.282334 0.080338 V\n0.779888 0.779888 0.079961 V\n0.719707 0.221827 0.918127 V\n0.221827 0.719707 0.918127 V\n0.945834 0.945834 0.539707 V\n0.445773 0.445773 0.538971 V\n0.654148 0.155217 0.194604 V\n0.155217 0.654148 0.194604 V\n0.622866 0.122506 0.826486 O\n0.122506 0.622866 0.826486 O\n0.248894 0.248894 0.953828 O\n0.749648 0.749648 0.952090 O\n0.843176 0.843176 0.463224 O\n0.343456 0.343456 0.462500 O\n0.772100 0.772100 0.728401 O\n0.271325 0.271325 0.730357 O\n0.036861 0.538040 0.327733 O\n0.538040 0.036861 0.327733 O\n0.946988 0.447072 0.553723 O\n0.447072 0.946988 0.553723 O\n0.566827 0.067263 0.072941 O\n0.067263 0.566827 0.072941 O\n0.320828 0.824309 0.816780 O\n0.824309 0.320828 0.816780 O\n0.177838 0.177838 0.180178 O\n0.678760 0.678760 0.182355 O\n0.432244 0.432244 0.925914 O\n0.934598 0.934598 0.926909 O\n0.052684 0.052684 0.448055 O\n0.552646 0.552646 0.447658 O\n0.961740 0.961740 0.673915 O\n0.461641 0.461641 0.673836 O\n0.733119 0.224921 0.268689 O\n0.224921 0.733119 0.268689 O\n0.656159 0.156700 0.537883 O\n0.156700 0.656159 0.537883 O\n0.251910 0.750027 0.045631 O\n0.750027 0.251910 0.045631 O\n0.376142 0.376142 0.173345 O\n0.878267 0.878267 0.171751 O\n",
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"formula_full": "Na5 V12 O32",
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{
"id": "mp-1021424",
"created_at": "2022-09-04T14:43:40.184041Z",
"structure_string": "K1 Mg6 Mo1\n1.0\n3.201236 -5.544704 0.000000\n3.201236 5.544704 0.000000\n0.000000 0.000000 5.096267\nK Mg Mo\n1 6 1\ndirect\n0.333333 0.666667 0.000000 K\n0.849394 0.698789 0.000000 Mg\n0.849394 0.150606 0.000000 Mg\n0.301211 0.150606 0.000000 Mg\n0.508538 0.017077 0.500000 Mg\n0.508538 0.491462 0.500000 Mg\n0.982923 0.491462 0.500000 Mg\n0.000000 0.000000 0.500000 Mo\n",
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"elements": [
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},
{
"id": "mp-1202960",
"created_at": "2022-09-04T14:43:40.113392Z",
"structure_string": "Sb16 O24\n1.0\n7.613406 0.000000 0.000000\n0.000000 7.777176 0.000000\n0.000000 0.000000 12.067859\nSb O\n16 24\ndirect\n0.735531 0.779036 0.984517 Sb\n0.235531 0.720964 0.015483 Sb\n0.764469 0.220964 0.484517 Sb\n0.264469 0.279036 0.515483 Sb\n0.525053 0.068831 0.257833 Sb\n0.025053 0.431169 0.742167 Sb\n0.974947 0.931169 0.757833 Sb\n0.474947 0.568831 0.242167 Sb\n0.498431 0.003662 0.759573 Sb\n0.998431 0.496338 0.240427 Sb\n0.001569 0.996338 0.259573 Sb\n0.501569 0.503662 0.740427 Sb\n0.273620 0.248622 0.983639 Sb\n0.773620 0.251378 0.016361 Sb\n0.226380 0.751378 0.483639 Sb\n0.726380 0.748622 0.516361 Sb\n0.383397 0.770247 0.149261 O\n0.883397 0.729753 0.850739 O\n0.116603 0.229753 0.649261 O\n0.616603 0.270247 0.350739 O\n0.522095 0.850844 0.894113 O\n0.022095 0.649156 0.105887 O\n0.977905 0.149156 0.394113 O\n0.477905 0.350844 0.605887 O\n0.439903 0.216951 0.855254 O\n0.939903 0.283049 0.144746 O\n0.060097 0.783049 0.355254 O\n0.560097 0.716951 0.644746 O\n0.753192 0.070588 0.750745 O\n0.253192 0.429412 0.249255 O\n0.746808 0.929412 0.250745 O\n0.246808 0.570588 0.749255 O\n0.854189 0.008355 0.997886 O\n0.354189 0.491645 0.002114 O\n0.645811 0.991645 0.497886 O\n0.145811 0.508355 0.502114 O\n0.559414 0.188318 0.111627 O\n0.059414 0.311682 0.888373 O\n0.940586 0.811682 0.611627 O\n0.440586 0.688318 0.388373 O\n",
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"formula_full": "Sb16 O24",
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},
{
"id": "mp-1203893",
"created_at": "2022-09-04T14:43:40.133568Z",
"structure_string": "Sr4 P12 H60 N16 O40\n1.0\n10.645715 0.000000 0.000000\n0.000000 10.988583 0.000000\n0.000000 6.579033 11.293453\nSr P H N O\n4 12 60 16 40\ndirect\n0.974493 0.846780 0.453535 Sr\n0.525507 0.846780 0.953535 Sr\n0.025507 0.153220 0.546465 Sr\n0.474493 0.153220 0.046465 Sr\n0.646285 0.926801 0.348076 P\n0.853715 0.926801 0.848076 P\n0.353715 0.073199 0.651924 P\n0.146285 0.073199 0.151924 P\n0.722080 0.047671 0.497304 P\n0.777920 0.047671 0.997304 P\n0.277920 0.952329 0.502696 P\n0.222080 0.952329 0.002696 P\n0.659463 0.743412 0.605819 P\n0.840537 0.743412 0.105819 P\n0.340537 0.256588 0.394181 P\n0.159463 0.256588 0.894181 P\n0.567362 0.114180 0.359652 H\n0.932638 0.114180 0.859652 H\n0.432638 0.885820 0.640348 H\n0.067362 0.885820 0.140348 H\n0.674207 0.887197 0.690361 H\n0.825793 0.887197 0.190361 H\n0.325793 0.112803 0.309639 H\n0.174207 0.112803 0.809639 H\n0.492864 0.795741 0.480492 H\n0.007136 0.795741 0.980492 H\n0.507136 0.204259 0.519508 H\n0.992864 0.204259 0.019508 H\n0.338818 0.663984 0.379392 H\n0.161182 0.663984 0.879392 H\n0.661182 0.336016 0.620608 H\n0.838818 0.336016 0.120608 H\n0.281498 0.808721 0.259646 H\n0.218502 0.808721 0.759646 H\n0.718502 0.191279 0.740354 H\n0.781498 0.191279 0.240354 H\n0.430593 0.815106 0.299892 H\n0.069407 0.815106 0.799892 H\n0.569407 0.184894 0.700108 H\n0.930593 0.184894 0.200108 H\n0.390777 0.711897 0.242399 H\n0.109223 0.711897 0.742399 H\n0.609223 0.288103 0.757601 H\n0.890777 0.288103 0.257601 H\n0.200080 0.671842 0.592347 H\n0.299920 0.671842 0.092347 H\n0.799920 0.328158 0.407653 H\n0.700080 0.328158 0.907653 H\n0.108478 0.545666 0.677155 H\n0.391522 0.545666 0.177155 H\n0.891522 0.454334 0.322845 H\n0.608478 0.454334 0.822845 H\n0.101091 0.605417 0.428984 H\n0.398909 0.605417 0.928984 H\n0.898909 0.394583 0.571016 H\n0.601091 0.394583 0.071016 H\n0.996173 0.656569 0.327165 H\n0.503827 0.656569 0.827165 H\n0.003827 0.343431 0.672835 H\n0.496173 0.343431 0.172835 H\n0.760102 0.569788 0.535286 H\n0.739898 0.569788 0.035286 H\n0.239898 0.430212 0.464714 H\n0.260102 0.430212 0.964714 H\n0.696568 0.529542 0.444714 H\n0.803432 0.529542 0.944714 H\n0.303432 0.470458 0.555286 H\n0.196568 0.470458 0.055286 H\n0.361518 0.407818 0.754611 H\n0.138482 0.407818 0.254611 H\n0.638482 0.592182 0.245389 H\n0.861518 0.592182 0.745389 H\n0.460140 0.522998 0.673089 H\n0.039860 0.522998 0.173089 H\n0.539860 0.477002 0.326911 H\n0.960140 0.477002 0.826911 H\n0.653451 0.066047 0.372828 N\n0.846549 0.066047 0.872828 N\n0.346549 0.933953 0.627172 N\n0.153451 0.933953 0.127172 N\n0.659296 0.896299 0.608393 N\n0.840704 0.896299 0.108393 N\n0.340704 0.103701 0.391607 N\n0.159296 0.103701 0.891607 N\n0.589831 0.788793 0.475419 N\n0.910169 0.788793 0.975419 N\n0.410169 0.211207 0.524581 N\n0.089831 0.211207 0.024581 N\n0.361994 0.749796 0.297030 N\n0.138006 0.749796 0.797030 N\n0.638006 0.250204 0.702970 N\n0.861994 0.250204 0.202970 N\n0.779930 0.894970 0.329960 O\n0.720070 0.894970 0.829960 O\n0.220070 0.105030 0.670040 O\n0.279930 0.105030 0.170040 O\n0.549563 0.962332 0.253010 O\n0.950437 0.962332 0.753010 O\n0.450437 0.037668 0.746990 O\n0.049563 0.037668 0.246990 O\n0.862566 0.029976 0.484797 O\n0.637434 0.029976 0.984797 O\n0.137434 0.970024 0.515203 O\n0.362566 0.970024 0.015203 O\n0.684967 0.169116 0.513733 O\n0.815033 0.169116 0.013733 O\n0.315033 0.830884 0.486267 O\n0.184967 0.830884 0.986267 O\n0.792762 0.695116 0.600398 O\n0.707238 0.695116 0.100398 O\n0.207238 0.304884 0.399602 O\n0.292762 0.304884 0.899602 O\n0.577091 0.638601 0.707059 O\n0.922909 0.638601 0.207059 O\n0.422909 0.361399 0.292941 O\n0.077091 0.361399 0.792941 O\n0.114908 0.649178 0.627268 O\n0.385092 0.649178 0.127268 O\n0.885092 0.350822 0.372732 O\n0.614908 0.350822 0.872732 O\n0.034112 0.675307 0.386836 O\n0.465888 0.675307 0.886836 O\n0.965888 0.324693 0.613164 O\n0.534112 0.324693 0.113164 O\n0.750056 0.493851 0.516580 O\n0.749944 0.493851 0.016580 O\n0.249944 0.506149 0.483420 O\n0.250056 0.506149 0.983420 O\n0.400633 0.453388 0.674972 O\n0.099367 0.453388 0.174972 O\n0.599367 0.546612 0.325028 O\n0.900633 0.546612 0.825028 O\n",
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"formula_full": "Sr4 P12 H60 N16 O40",
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{
"id": "mp-976185",
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"structure_string": "Na1 Be1 O3\n1.0\n3.589369 0.000000 0.000000\n0.000000 3.589369 0.000000\n0.000000 0.000000 3.589369\nNa Be O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Be\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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{
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"structure_string": "Li2 F6\n1.0\n2.209154 -3.826366 0.000000\n2.209154 3.826366 0.000000\n0.000000 0.000000 4.653021\nLi F\n2 6\ndirect\n0.666667 0.333333 0.250000 Li\n0.333333 0.666667 0.750000 Li\n0.831234 0.168766 0.750000 F\n0.337532 0.168766 0.750000 F\n0.831234 0.662468 0.750000 F\n0.168766 0.831234 0.250000 F\n0.662468 0.831234 0.250000 F\n0.168766 0.337532 0.250000 F\n",
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{
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"structure_string": "La1 Al2 Si2\n1.0\n2.126419 -3.683066 0.000000\n2.126419 3.683066 0.000000\n0.000000 0.000000 6.975756\nLa Al Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 La\n0.333333 0.666667 0.636955 Al\n0.666667 0.333333 0.363045 Al\n0.333333 0.666667 0.272911 Si\n0.666667 0.333333 0.727089 Si\n",
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{
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{
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{
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