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{
"id": "mp-542785",
"created_at": "2022-09-04T14:42:17.771304Z",
"structure_string": "Mg4 H24 C8 O24\n1.0\n7.203791 0.000000 0.000000\n0.000000 8.724938 0.000000\n0.000000 1.325632 9.366002\nMg H C O\n4 24 8 24\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.609616 0.208621 0.992446 H\n0.109616 0.791379 0.507554 H\n0.390384 0.791379 0.007554 H\n0.890384 0.208621 0.492446 H\n0.393688 0.233466 0.954682 H\n0.893688 0.766534 0.545318 H\n0.606312 0.766534 0.045318 H\n0.106312 0.233466 0.454682 H\n0.525171 0.329912 0.613127 H\n0.025171 0.670088 0.886873 H\n0.474829 0.670088 0.386873 H\n0.974829 0.329912 0.113127 H\n0.707554 0.926784 0.775726 H\n0.207554 0.073216 0.724274 H\n0.292446 0.073216 0.224274 H\n0.792446 0.926784 0.275726 H\n0.847625 0.468147 0.777267 H\n0.347625 0.531853 0.722733 H\n0.152375 0.531853 0.222733 H\n0.652375 0.468147 0.277267 H\n0.898611 0.301856 0.736916 H\n0.398611 0.698144 0.763084 H\n0.101389 0.698144 0.263084 H\n0.601389 0.301856 0.236916 H\n0.774853 0.034763 0.726165 C\n0.274853 0.965237 0.773835 C\n0.225147 0.965237 0.273835 C\n0.725147 0.034763 0.226165 C\n0.384934 0.325520 0.565909 C\n0.884934 0.674480 0.934091 C\n0.615066 0.674480 0.434091 C\n0.115066 0.325520 0.065909 C\n0.892505 0.097764 0.799590 O\n0.392505 0.902236 0.700410 O\n0.107495 0.902236 0.200410 O\n0.607495 0.097764 0.299590 O\n0.728336 0.087675 0.598947 O\n0.228336 0.912325 0.901053 O\n0.271664 0.912325 0.401053 O\n0.771664 0.087675 0.098947 O\n0.275602 0.436635 0.579187 O\n0.775602 0.563365 0.920813 O\n0.724398 0.563365 0.420813 O\n0.224398 0.436635 0.079187 O\n0.345329 0.208832 0.503915 O\n0.845329 0.791168 0.996085 O\n0.654671 0.791168 0.496085 O\n0.154671 0.208832 0.003915 O\n0.519629 0.279158 0.936531 O\n0.019629 0.720842 0.563469 O\n0.480371 0.720842 0.063469 O\n0.980371 0.279158 0.436531 O\n0.890780 0.413151 0.698223 O\n0.390780 0.586849 0.801777 O\n0.109220 0.586849 0.301777 O\n0.609220 0.413151 0.198223 O\n",
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"formula_full": "Mg4 H24 C8 O24",
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"updated_at": "2021-11-28T01:35:40.191000Z",
"spacegroup": 14
},
{
"id": "mp-1305171",
"created_at": "2022-09-04T14:40:55.457645Z",
"structure_string": "Li4 Mn4 C8 O24\n1.0\n-0.129902 -6.346893 3.930870\n6.975332 -0.940187 3.871212\n-4.667211 4.197239 4.005710\nLi Mn C O\n4 4 8 24\ndirect\n0.500692 0.999853 0.499931 Li\n0.750191 0.499883 0.749962 Li\n0.000410 0.999949 0.999836 Li\n0.250154 0.499898 0.249944 Li\n0.250008 0.499822 0.749926 Mn\n0.500188 0.999986 0.000466 Mn\n0.749661 0.500067 0.250001 Mn\n0.000275 0.999715 0.500067 Mn\n0.392506 0.743231 0.124930 C\n0.630016 0.248637 0.365083 C\n0.892548 0.743189 0.624966 C\n0.129988 0.248531 0.864915 C\n0.107223 0.256913 0.374956 C\n0.369990 0.751484 0.635213 C\n0.607333 0.256891 0.874996 C\n0.869952 0.751434 0.135070 C\n0.464179 0.262115 0.744386 O\n0.748647 0.751410 0.990362 O\n0.964046 0.262261 0.244426 O\n0.248763 0.751429 0.490421 O\n0.070521 0.387289 0.793281 O\n0.329827 0.886740 0.060224 O\n0.570395 0.387344 0.293368 O\n0.829815 0.886699 0.560143 O\n0.309551 0.616665 0.062583 O\n0.556720 0.110636 0.286950 O\n0.809505 0.616694 0.562628 O\n0.056716 0.110582 0.786728 O\n0.190258 0.383504 0.437513 O\n0.443481 0.889282 0.713623 O\n0.690288 0.383457 0.937493 O\n0.943482 0.889194 0.213382 O\n0.429322 0.612621 0.706623 O\n0.669953 0.113221 0.939525 O\n0.929260 0.612608 0.206553 O\n0.169899 0.113207 0.439412 O\n0.035851 0.737927 0.755327 O\n0.251234 0.248803 0.009681 O\n0.535832 0.737966 0.255383 O\n0.751322 0.248865 0.509724 O\n",
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"formula_full": "Li4 Mn4 C8 O24",
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{
"id": "mp-1034101",
"created_at": "2022-09-04T14:42:04.144658Z",
"structure_string": "Na1 Mg14 Ti1 O16\n1.0\n8.567290 0.000000 0.000000\n0.000000 8.571864 -0.000000\n0.000000 -0.000000 4.275154\nNa Mg Ti O\n1 14 1 16\ndirect\n-0.000000 0.500000 0.000000 Na\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n-0.000000 0.259202 0.500000 Mg\n-0.000000 0.740798 0.500000 Mg\n0.500000 0.252428 0.500000 Mg\n0.500000 0.747572 0.500000 Mg\n0.252814 -0.000000 0.500000 Mg\n0.247276 0.500000 0.500000 Mg\n0.747186 0.000000 0.500000 Mg\n0.752724 0.500000 0.500000 Mg\n0.252170 0.256289 0.000000 Mg\n0.252170 0.743711 -0.000000 Mg\n0.747830 0.256289 0.000000 Mg\n0.747830 0.743711 0.000000 Mg\n-0.000000 -0.000000 0.000000 Ti\n0.247457 -0.000000 0.000000 O\n0.264219 0.500000 0.000000 O\n0.752543 -0.000000 -0.000000 O\n0.735781 0.500000 0.000000 O\n0.248758 0.248311 0.500000 O\n0.248758 0.751689 0.500000 O\n0.751242 0.248311 0.500000 O\n0.751242 0.751689 0.500000 O\n-0.000000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n-0.000000 0.232320 0.000000 O\n-0.000000 0.767680 -0.000000 O\n0.500000 0.244789 -0.000000 O\n0.500000 0.755211 0.000000 O\n",
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"elements": [
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],
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"density_atomic": 0.10192470776477104,
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"formula_full": "Na1 Mg14 Ti1 O16",
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{
"id": "mp-1213050",
"created_at": "2022-09-04T14:39:47.497097Z",
"structure_string": "Dy4 Ni2 B20\n1.0\n0.000000 0.000000 4.143641\n5.552728 0.000000 0.000000\n0.000000 11.086683 0.000000\nDy Ni B\n4 2 20\ndirect\n0.500000 0.192966 0.363582 Dy\n0.500000 0.807034 0.636418 Dy\n0.500000 0.307034 0.863582 Dy\n0.500000 0.692966 0.136418 Dy\n0.000000 0.000000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.374860 0.040944 B\n0.000000 0.625140 0.959056 B\n0.000000 0.125140 0.540944 B\n0.000000 0.874860 0.459056 B\n0.000000 0.345922 0.197367 B\n0.000000 0.654078 0.802633 B\n0.000000 0.154078 0.697367 B\n0.000000 0.845922 0.302633 B\n0.000000 0.035439 0.187805 B\n0.000000 0.964561 0.812195 B\n0.000000 0.464561 0.687805 B\n0.000000 0.535439 0.312195 B\n0.300733 0.203686 0.114002 B\n0.699267 0.796314 0.885998 B\n0.300733 0.796314 0.885998 B\n0.699267 0.296314 0.614002 B\n0.699267 0.203686 0.114002 B\n0.300733 0.703686 0.385998 B\n0.699267 0.703686 0.385998 B\n0.300733 0.296314 0.614002 B\n",
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{
"id": "mp-1036207",
"created_at": "2022-09-04T14:48:07.930815Z",
"structure_string": "Mg14 Mn1 Zn1 O16\n1.0\n4.285149 0.000000 0.000000\n0.000000 8.547478 0.000000\n0.000000 0.000000 8.571587\nMg Mn Zn O\n14 1 1 16\ndirect\n0.000000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.747168 0.000000 Mg\n0.500000 0.252832 0.000000 Mg\n0.500000 0.750186 0.500000 Mg\n0.500000 0.249814 0.500000 Mg\n0.500000 0.000000 0.748077 Mg\n0.500000 0.500000 0.749694 Mg\n0.500000 0.000000 0.251923 Mg\n0.500000 0.500000 0.250306 Mg\n0.000000 0.748650 0.748962 Mg\n0.000000 0.251350 0.748962 Mg\n0.000000 0.748650 0.251038 Mg\n0.000000 0.251350 0.251038 Mg\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Zn\n0.000000 0.000000 0.742342 O\n0.000000 0.500000 0.744332 O\n0.000000 0.000000 0.257658 O\n0.000000 0.500000 0.255668 O\n0.500000 0.750001 0.751157 O\n0.500000 0.249999 0.751157 O\n0.500000 0.750001 0.248843 O\n0.500000 0.249999 0.248843 O\n0.500000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.745224 0.000000 O\n0.000000 0.254776 0.000000 O\n0.000000 0.749800 0.500000 O\n0.000000 0.250200 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:44:58.662131Z",
"structure_string": "Li10 Ga2 O8\n1.0\n6.431393 0.000000 0.000000\n0.000000 6.431393 0.000000\n0.000000 0.000000 4.743881\nLi Ga O\n10 2 8\ndirect\n0.000000 0.500000 0.976437 Li\n0.500000 0.000000 0.023563 Li\n0.500000 0.500000 0.000000 Li\n0.736173 0.263827 0.000000 Li\n0.263827 0.736173 0.000000 Li\n0.236173 0.236173 0.500000 Li\n0.500000 0.000000 0.523563 Li\n0.000000 0.000000 0.500000 Li\n0.763827 0.763827 0.500000 Li\n0.000000 0.500000 0.476437 Li\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Ga\n0.760701 0.004911 0.768686 O\n0.739299 0.504911 0.731314 O\n0.239299 0.995089 0.768686 O\n0.260701 0.495089 0.731314 O\n0.495089 0.260701 0.268686 O\n0.504911 0.739299 0.268686 O\n0.995089 0.239299 0.231314 O\n0.004911 0.760701 0.231314 O\n",
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{
"id": "mp-1227607",
"created_at": "2022-09-04T14:42:58.630246Z",
"structure_string": "Co2 H30 N12 Cl4 O4\n1.0\n6.881588 0.000000 0.000000\n1.252295 6.779413 0.000000\n0.680271 0.600191 10.935409\nCo H N Cl O\n2 30 12 4 4\ndirect\n0.711508 0.288766 0.750216 Co\n0.288492 0.711234 0.249784 Co\n0.448468 0.125809 0.669367 H\n0.873588 0.552843 0.830639 H\n0.551532 0.874191 0.330633 H\n0.126412 0.447157 0.169361 H\n0.547201 0.285756 0.963749 H\n0.714819 0.452288 0.536339 H\n0.452799 0.714244 0.036251 H\n0.285181 0.547712 0.463661 H\n0.763326 0.136852 0.965476 H\n0.864439 0.236377 0.535545 H\n0.236674 0.863148 0.034524 H\n0.135561 0.763623 0.464455 H\n0.423474 0.119993 0.821271 H\n0.878972 0.577543 0.678924 H\n0.576526 0.880007 0.178729 H\n0.121028 0.422457 0.321076 H\n0.753192 0.379018 0.965864 H\n0.621518 0.246936 0.534094 H\n0.246808 0.620982 0.034136 H\n0.378482 0.753064 0.465906 H\n0.594307 0.956950 0.751077 H\n0.042867 0.408029 0.749602 H\n0.405693 0.043050 0.248923 H\n0.957133 0.591971 0.250398 H\n0.070793 0.104934 0.737877 H\n0.929207 0.895066 0.262123 H\n0.928332 0.970630 0.679189 H\n0.071668 0.029370 0.320811 H\n0.938217 0.974781 0.830752 H\n0.061783 0.025219 0.169248 H\n0.937325 0.059408 0.749867 N\n0.062675 0.940592 0.250133 N\n0.692076 0.271454 0.930270 N\n0.729223 0.307703 0.570008 N\n0.307924 0.728546 0.069730 N\n0.270777 0.692297 0.429992 N\n0.492765 0.506946 0.749914 N\n0.507235 0.493054 0.250086 N\n0.525860 0.101757 0.747954 N\n0.897448 0.475120 0.752357 N\n0.474140 0.898243 0.252046 N\n0.102552 0.524880 0.247643 N\n0.780601 0.806694 0.516013 Cl\n0.192880 0.219482 0.986684 Cl\n0.219399 0.193306 0.483987 Cl\n0.807120 0.780518 0.013316 Cl\n0.349618 0.502290 0.686906 O\n0.497102 0.650141 0.813014 O\n0.650382 0.497710 0.313094 O\n0.502898 0.349859 0.186986 O\n",
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{
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