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{
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"results": [
{
"id": "mp-1233274",
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"structure_string": "Rb2 Ba8 Ca1 Sb6 O2\n1.0\n8.628227 -0.362976 -3.897241\n-2.303270 8.100155 -3.847982\n0.005252 0.116575 10.481182\nRb Ba Ca Sb O\n2 8 1 6 2\ndirect\n0.004023 0.007531 0.000075 Rb\n0.412672 0.412425 0.813199 Rb\n0.507862 0.722325 0.693136 Ba\n0.197720 0.987446 0.701439 Ba\n0.827233 0.038844 0.325834 Ba\n0.992663 0.545517 0.741157 Ba\n0.512950 0.300494 0.326332 Ba\n0.759015 0.206102 0.739476 Ba\n0.025877 0.487532 0.292951 Ba\n0.272541 0.823989 0.292633 Ba\n0.589407 0.593189 0.171396 Ca\n0.825264 0.641277 0.022549 Sb\n0.618643 0.144945 0.012831 Sb\n0.208297 0.396029 0.024005 Sb\n0.406036 0.878861 0.012746 Sb\n0.219716 0.227055 0.428940 Sb\n0.776251 0.773196 0.537503 Sb\n0.771596 0.271484 0.532356 O\n0.257949 0.763188 0.506442 O\n",
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{
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"structure_string": "Cs3 Bi2 Cl9\n1.0\n3.994073 -6.917937 0.000000\n3.994073 6.917937 0.000000\n0.000000 0.000000 9.726690\nCs Bi Cl\n3 2 9\ndirect\n0.000000 0.000000 0.000000 Cs\n0.666667 0.333333 0.672371 Cs\n0.333333 0.666667 0.327629 Cs\n0.666667 0.333333 0.175444 Bi\n0.333333 0.666667 0.824556 Bi\n0.467954 0.000000 0.000000 Cl\n0.532046 0.532046 0.000000 Cl\n0.000000 0.467954 0.000000 Cl\n0.150256 0.796000 0.676877 Cl\n0.645744 0.849744 0.676877 Cl\n0.204000 0.354256 0.676877 Cl\n0.849744 0.645744 0.323123 Cl\n0.796000 0.150256 0.323123 Cl\n0.354256 0.204000 0.323123 Cl\n",
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"updated_at": "2021-11-28T01:34:38.856000Z",
"spacegroup": 150
},
{
"id": "mp-1233263",
"created_at": "2022-09-04T14:39:16.207718Z",
"structure_string": "K2 Nd4 Mg1 Nb2 O12\n1.0\n5.868281 0.181331 0.048531\n-2.764154 6.195707 -1.649665\n0.099737 0.147681 8.736936\nK Nd Mg Nb O\n2 4 1 2 12\ndirect\n0.121381 0.237300 0.475773 K\n0.969930 0.819359 0.614328 K\n0.153999 0.283878 0.939595 Nd\n0.550101 0.100336 0.193771 Nd\n0.451174 0.831582 0.786816 Nd\n0.895456 0.753768 0.048159 Nd\n0.638490 0.568717 0.350363 Mg\n0.679420 0.335736 0.697771 Nb\n0.230494 0.640229 0.290518 Nb\n0.012946 0.541727 0.807226 O\n0.183555 0.899164 0.296928 O\n0.262073 0.993311 0.980876 O\n0.801392 0.117705 0.707270 O\n0.636103 0.818014 0.264143 O\n0.777060 0.015683 0.990056 O\n0.350067 0.138575 0.713852 O\n0.885945 0.473527 0.199746 O\n0.683076 0.369156 0.487104 O\n0.405873 0.664142 0.504372 O\n0.332627 0.376111 0.209012 O\n0.562173 0.549759 0.842320 O\n",
"nsites": 21,
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"elements": [
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},
{
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"structure_string": "H24 O12\n1.0\n3.801783 -6.584882 0.000000\n3.801783 6.584882 0.000000\n0.000000 0.000000 7.142962\nH O\n24 12\ndirect\n0.330823 0.330823 0.696428 H\n0.669177 0.000000 0.696428 H\n0.000000 0.669177 0.696428 H\n0.669177 0.669177 0.196428 H\n0.330823 0.000000 0.196428 H\n0.000000 0.330823 0.196428 H\n0.452347 0.452347 0.510646 H\n0.547653 0.000000 0.510646 H\n0.000000 0.547653 0.510646 H\n0.547653 0.547653 0.010646 H\n0.452347 0.000000 0.010646 H\n0.000000 0.452347 0.010646 H\n0.786171 0.663716 0.478847 H\n0.336284 0.122455 0.478847 H\n0.877545 0.213829 0.478847 H\n0.663716 0.786171 0.478847 H\n0.122455 0.336284 0.478847 H\n0.213829 0.877545 0.478847 H\n0.213829 0.336284 0.978847 H\n0.663716 0.877545 0.978847 H\n0.122455 0.786171 0.978847 H\n0.336284 0.213829 0.978847 H\n0.877545 0.663716 0.978847 H\n0.786171 0.122455 0.978847 H\n0.326642 0.326642 0.555658 O\n0.673358 0.000000 0.555658 O\n0.000000 0.673358 0.555658 O\n0.673358 0.673358 0.055658 O\n0.326642 0.000000 0.055658 O\n0.000000 0.326642 0.055658 O\n0.660605 0.660605 0.429575 O\n0.339395 0.000000 0.429575 O\n0.000000 0.339395 0.429575 O\n0.339395 0.339395 0.929575 O\n0.660605 0.000000 0.929575 O\n0.000000 0.660605 0.929575 O\n",
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"elements": [
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"formula_full": "H24 O12",
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"spacegroup": 185
},
{
"id": "mp-1522424",
"created_at": "2022-09-04T14:39:16.180244Z",
"structure_string": "Ba4 Sr4 La4 Bi4 O24\n1.0\n8.816923 0.000000 0.000000\n0.000000 8.825894 0.000000\n0.000000 0.000000 8.817114\nBa Sr La Bi O\n4 4 4 4 24\ndirect\n0.000000 -0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 0.500000 0.000000 Ba\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.000000 0.000000 Sr\n0.000000 -0.000000 0.500000 Sr\n0.250118 0.247420 0.252091 La\n0.749882 0.752580 0.252091 La\n0.749882 0.247420 0.747909 La\n0.250118 0.752580 0.747909 La\n0.749548 0.754155 0.747043 Bi\n0.250452 0.245845 0.747043 Bi\n0.250452 0.754155 0.252957 Bi\n0.749548 0.245845 0.252957 Bi\n0.986423 0.203359 0.289811 O\n0.013577 0.796641 0.289811 O\n0.013577 0.203359 0.710189 O\n0.986423 0.796641 0.710189 O\n0.289289 0.989097 0.206149 O\n0.289289 0.010903 0.793851 O\n0.710712 0.010903 0.206149 O\n0.710712 0.989097 0.793851 O\n0.215768 0.278066 0.986223 O\n0.784232 0.278066 0.013777 O\n0.215768 0.721934 0.013777 O\n0.784232 0.721934 0.986223 O\n0.511537 0.287155 0.224459 O\n0.488463 0.712845 0.224459 O\n0.488463 0.287155 0.775541 O\n0.511537 0.712845 0.775541 O\n0.212083 0.515240 0.294581 O\n0.212083 0.484760 0.705419 O\n0.787918 0.484760 0.294581 O\n0.787918 0.515240 0.705419 O\n0.293304 0.206355 0.511326 O\n0.706696 0.206355 0.488674 O\n0.293304 0.793645 0.488674 O\n0.706696 0.793645 0.511326 O\n",
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{
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"structure_string": "Li12 Bi8 P12 O48\n1.0\n9.237253 0.000000 0.000000\n0.000000 9.308850 0.000000\n0.000000 9.189796 13.144612\nLi Bi P O\n12 8 12 48\ndirect\n0.111801 0.224830 0.692843 Li\n0.714403 0.180958 0.743647 Li\n0.769980 0.611316 0.179299 Li\n0.269980 0.388684 0.320701 Li\n0.214403 0.819042 0.756353 Li\n0.611801 0.775170 0.807157 Li\n0.388199 0.224830 0.192843 Li\n0.785597 0.180958 0.243647 Li\n0.730020 0.611316 0.679299 Li\n0.230020 0.388684 0.820701 Li\n0.285597 0.819042 0.256353 Li\n0.888199 0.775170 0.307157 Li\n0.446663 0.658854 0.101458 Bi\n0.040415 0.853527 0.900020 Bi\n0.540415 0.146473 0.599980 Bi\n0.946663 0.341146 0.398542 Bi\n0.053337 0.658854 0.601458 Bi\n0.459585 0.853527 0.400020 Bi\n0.959585 0.146473 0.099980 Bi\n0.553337 0.341146 0.898542 Bi\n0.241633 0.464012 0.489387 P\n0.390198 0.067809 0.834780 P\n0.092227 0.734451 0.168029 P\n0.592227 0.265549 0.331971 P\n0.890198 0.932191 0.665220 P\n0.741633 0.535988 0.010613 P\n0.258367 0.464012 0.989387 P\n0.109802 0.067809 0.334780 P\n0.407773 0.734451 0.668029 P\n0.907773 0.265549 0.831971 P\n0.609802 0.932191 0.165220 P\n0.758367 0.535988 0.510613 P\n0.871101 0.546303 0.435151 O\n0.710090 0.344004 0.591775 O\n0.899224 0.115179 0.815159 O\n0.610294 0.756495 0.173794 O\n0.369631 0.346772 0.554842 O\n0.245388 0.054014 0.789637 O\n0.175479 0.391010 0.431172 O\n0.401408 0.911749 0.947405 O\n0.071929 0.808160 0.055398 O\n0.238831 0.635410 0.209005 O\n0.960344 0.618197 0.231863 O\n0.523133 0.065370 0.774669 O\n0.023133 0.934630 0.725331 O\n0.460344 0.381803 0.268137 O\n0.738831 0.364590 0.290995 O\n0.571929 0.191840 0.444602 O\n0.901408 0.088251 0.552595 O\n0.675479 0.608990 0.068828 O\n0.745388 0.945986 0.710363 O\n0.869631 0.653228 0.945158 O\n0.110294 0.243505 0.326206 O\n0.399224 0.884821 0.684841 O\n0.210090 0.655996 0.908225 O\n0.371101 0.453697 0.064849 O\n0.628899 0.546303 0.935151 O\n0.789910 0.344004 0.091775 O\n0.600776 0.115179 0.315159 O\n0.889706 0.756495 0.673794 O\n0.130369 0.346772 0.054842 O\n0.254612 0.054014 0.289637 O\n0.324521 0.391010 0.931172 O\n0.098592 0.911749 0.447405 O\n0.428071 0.808160 0.555398 O\n0.261169 0.635410 0.709005 O\n0.539656 0.618197 0.731863 O\n0.976867 0.065370 0.274669 O\n0.476867 0.934630 0.225331 O\n0.039656 0.381803 0.768137 O\n0.761169 0.364590 0.790995 O\n0.928071 0.191840 0.944602 O\n0.598592 0.088251 0.052595 O\n0.824521 0.608990 0.568828 O\n0.754612 0.945986 0.210363 O\n0.630369 0.653228 0.445158 O\n0.389706 0.243505 0.826206 O\n0.100776 0.884821 0.184841 O\n0.289910 0.655996 0.408225 O\n0.128899 0.453697 0.564849 O\n",
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{
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{
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{
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}