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{
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{
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"formula_full": "Ca12 Be8 Si12 H8 O48",
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{
"id": "mp-1042855",
"created_at": "2022-09-04T14:39:09.975171Z",
"structure_string": "Ca4 Mo6 O16\n1.0\n3.226366 -5.588230 0.000000\n3.226366 5.588230 0.000000\n0.000000 0.000000 10.367043\nCa Mo O\n4 6 16\ndirect\n0.666667 0.333333 0.027308 Ca\n0.333333 0.666667 0.527308 Ca\n0.666667 0.333333 0.413699 Ca\n0.333333 0.666667 0.913699 Ca\n0.671912 0.835956 0.244487 Mo\n0.835956 0.164044 0.744487 Mo\n0.164044 0.328088 0.244487 Mo\n0.835956 0.671912 0.744487 Mo\n0.328088 0.164044 0.744487 Mo\n0.164044 0.835956 0.244487 Mo\n0.838394 0.161606 0.157504 O\n0.676787 0.838394 0.657504 O\n0.161606 0.323213 0.657504 O\n0.838394 0.676787 0.157504 O\n0.323213 0.161606 0.157504 O\n0.161606 0.838394 0.657504 O\n0.525844 0.474156 0.854513 O\n0.051688 0.525844 0.354513 O\n0.474156 0.948312 0.354513 O\n0.525844 0.051688 0.854513 O\n0.000000 0.000000 0.347466 O\n0.000000 0.000000 0.847466 O\n0.333333 0.666667 0.135518 O\n0.948312 0.474156 0.854513 O\n0.474156 0.525844 0.354513 O\n0.666667 0.333333 0.635518 O\n",
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"formula_full": "Ca4 Mo6 O16",
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"spacegroup": 186
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{
"id": "mp-754035",
"created_at": "2022-09-04T14:39:09.984365Z",
"structure_string": "Li4 Fe2 Ni3 O10\n1.0\n5.042113 0.000000 0.000000\n-0.822561 5.014876 0.000000\n-2.443855 -2.149529 7.051849\nLi Fe Ni O\n4 2 3 10\ndirect\n0.075666 0.770294 0.586970 Li\n0.699064 0.600266 0.217401 Li\n0.300936 0.399734 0.782599 Li\n0.924334 0.229706 0.413030 Li\n0.302623 0.897051 0.312972 Fe\n0.697377 0.102949 0.687028 Fe\n0.500000 0.000000 0.000000 Ni\n0.099199 0.299913 0.097790 Ni\n0.900801 0.700087 0.902210 Ni\n0.898468 0.941372 0.136929 O\n0.697338 0.888512 0.446942 O\n0.281721 0.670069 0.046161 O\n0.090780 0.542066 0.319925 O\n0.539027 0.776691 0.781321 O\n0.460973 0.223309 0.218679 O\n0.909220 0.457934 0.680075 O\n0.718279 0.329931 0.953839 O\n0.302662 0.111488 0.553058 O\n0.101532 0.058628 0.863071 O\n",
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{
"id": "mp-16390",
"created_at": "2022-09-04T14:39:09.987042Z",
"structure_string": "Dy16 Mo16 O44\n1.0\n10.866795 0.000000 0.000000\n0.000000 16.124808 0.000000\n0.000000 0.000000 5.756258\nDy Mo O\n16 16 44\ndirect\n0.616374 0.576298 0.000000 Dy\n0.383626 0.423702 0.000000 Dy\n0.116374 0.923702 0.000000 Dy\n0.883626 0.076298 0.000000 Dy\n0.406155 0.737298 0.000000 Dy\n0.593845 0.262702 0.000000 Dy\n0.906155 0.762702 0.000000 Dy\n0.093845 0.237298 0.000000 Dy\n0.424552 0.598825 0.500000 Dy\n0.575448 0.401175 0.500000 Dy\n0.924552 0.901175 0.500000 Dy\n0.075448 0.098825 0.500000 Dy\n0.185248 0.778059 0.500000 Dy\n0.814752 0.221941 0.500000 Dy\n0.685248 0.721941 0.500000 Dy\n0.314752 0.278059 0.500000 Dy\n0.917072 0.559990 0.000000 Mo\n0.082928 0.440010 0.000000 Mo\n0.417072 0.940010 0.000000 Mo\n0.582928 0.059990 0.000000 Mo\n0.902571 0.571777 0.500000 Mo\n0.097429 0.428223 0.500000 Mo\n0.402571 0.928223 0.500000 Mo\n0.597429 0.071777 0.500000 Mo\n0.858661 0.410769 0.274371 Mo\n0.141339 0.589231 0.274371 Mo\n0.358661 0.089231 0.725629 Mo\n0.641339 0.910769 0.725629 Mo\n0.141339 0.589231 0.725629 Mo\n0.858661 0.410769 0.725629 Mo\n0.641339 0.910769 0.274371 Mo\n0.358661 0.089231 0.274371 Mo\n0.000000 0.000000 0.245447 O\n0.500000 0.500000 0.754553 O\n0.000000 0.000000 0.754553 O\n0.500000 0.500000 0.245447 O\n0.231490 0.523444 0.000000 O\n0.768510 0.476556 0.000000 O\n0.731490 0.976556 0.000000 O\n0.268510 0.023444 0.000000 O\n0.048417 0.654045 0.000000 O\n0.951583 0.345955 0.000000 O\n0.548417 0.845955 0.000000 O\n0.451583 0.154045 0.000000 O\n0.246827 0.512335 0.500000 O\n0.753173 0.487665 0.500000 O\n0.746827 0.987665 0.500000 O\n0.253173 0.012335 0.500000 O\n0.039186 0.666514 0.500000 O\n0.960814 0.333486 0.500000 O\n0.311163 0.861566 0.763135 O\n0.460814 0.166514 0.500000 O\n0.958424 0.171642 0.247478 O\n0.041576 0.828358 0.247478 O\n0.458424 0.328358 0.752522 O\n0.541576 0.671642 0.752522 O\n0.041576 0.828358 0.752522 O\n0.958424 0.171642 0.752522 O\n0.541576 0.671642 0.247478 O\n0.458424 0.328358 0.247478 O\n0.688837 0.138434 0.236865 O\n0.311163 0.861566 0.236865 O\n0.188837 0.361566 0.763135 O\n0.811163 0.638434 0.763135 O\n0.220211 0.177223 0.264449 O\n0.779789 0.822777 0.264449 O\n0.720211 0.322777 0.735551 O\n0.279789 0.677223 0.735551 O\n0.779789 0.822777 0.735551 O\n0.220211 0.177223 0.735551 O\n0.279789 0.677223 0.264449 O\n0.720211 0.322777 0.264449 O\n0.188837 0.361566 0.236865 O\n0.811163 0.638434 0.236865 O\n0.688837 0.138434 0.763135 O\n0.539186 0.833486 0.500000 O\n",
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{
"id": "mp-765227",
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"structure_string": "Li12 Sn10 P16 O56\n1.0\n9.626733 0.000000 0.000000\n4.443575 10.519774 0.000000\n3.570913 1.712195 13.065612\nLi Sn P O\n12 10 16 56\ndirect\n0.039994 0.871592 0.575512 Li\n0.437939 0.654017 0.672039 Li\n0.000000 0.500000 0.500000 Li\n0.562061 0.345983 0.327961 Li\n0.960006 0.128408 0.424488 Li\n0.174737 0.057231 0.247574 Li\n0.050480 0.872813 0.051027 Li\n0.418937 0.704273 0.155947 Li\n0.000000 0.500000 0.000000 Li\n0.581063 0.295727 0.844053 Li\n0.949520 0.127187 0.948973 Li\n0.825263 0.942769 0.752426 Li\n0.596821 0.294082 0.597080 Sn\n0.194182 0.002076 0.752123 Sn\n0.260209 0.267762 0.571213 Sn\n0.739791 0.732238 0.428787 Sn\n0.805818 0.997924 0.247877 Sn\n0.403179 0.705918 0.402920 Sn\n0.586444 0.305527 0.100969 Sn\n0.265697 0.258036 0.078280 Sn\n0.734303 0.741964 0.921720 Sn\n0.413556 0.694473 0.899031 Sn\n0.224320 0.581291 0.595409 P\n0.679320 0.789965 0.659334 P\n0.897239 0.297599 0.717211 P\n0.718076 0.007895 0.513727 P\n0.281924 0.992105 0.486273 P\n0.102761 0.702401 0.282789 P\n0.320680 0.210035 0.340666 P\n0.775680 0.418709 0.404591 P\n0.225117 0.580394 0.094255 P\n0.664771 0.812515 0.157919 P\n0.894371 0.300911 0.216957 P\n0.713685 0.015026 0.995039 P\n0.286315 0.984974 0.004961 P\n0.105629 0.699089 0.783043 P\n0.335229 0.187485 0.842081 P\n0.774883 0.419606 0.905745 P\n0.046049 0.835863 0.726723 O\n0.117371 0.600242 0.707917 O\n0.258626 0.163516 0.765071 O\n0.394274 0.536287 0.604989 O\n0.540534 0.748339 0.705577 O\n0.840664 0.004699 0.568019 O\n0.611217 0.932093 0.591748 O\n0.731354 0.325919 0.707098 O\n0.183353 0.713049 0.528344 O\n0.181649 0.487874 0.554793 O\n0.611751 0.143738 0.485244 O\n0.002065 0.333765 0.619753 O\n0.798854 0.702411 0.580741 O\n0.207708 0.068073 0.581094 O\n0.792292 0.931927 0.418906 O\n0.201146 0.297589 0.419259 O\n0.997935 0.666235 0.380247 O\n0.388249 0.856262 0.514756 O\n0.818351 0.512126 0.445207 O\n0.816647 0.286951 0.471656 O\n0.268646 0.674081 0.292902 O\n0.388783 0.067907 0.408252 O\n0.159336 0.995301 0.431981 O\n0.459466 0.251661 0.294423 O\n0.035593 0.842816 0.230521 O\n0.605726 0.463713 0.395011 O\n0.741374 0.836484 0.234929 O\n0.114114 0.608040 0.205148 O\n0.882629 0.399758 0.292083 O\n0.250185 0.186462 0.262728 O\n0.394774 0.534263 0.106454 O\n0.953951 0.164137 0.273277 O\n0.521859 0.780217 0.213111 O\n0.851835 0.000804 0.040022 O\n0.604432 0.952377 0.086819 O\n0.727317 0.337026 0.203090 O\n0.190784 0.709787 0.024081 O\n0.179180 0.487644 0.056823 O\n0.616029 0.155400 0.970767 O\n0.003711 0.329799 0.119204 O\n0.780286 0.717485 0.085478 O\n0.234858 0.060395 0.096669 O\n0.765142 0.939605 0.903331 O\n0.219714 0.282515 0.914522 O\n0.996289 0.670201 0.880796 O\n0.383971 0.844600 0.029233 O\n0.820820 0.512356 0.943177 O\n0.809216 0.290213 0.975919 O\n0.272683 0.662974 0.796910 O\n0.395568 0.047623 0.913181 O\n0.148165 0.999196 0.959978 O\n0.478141 0.219783 0.786889 O\n0.605226 0.465737 0.893546 O\n0.749815 0.813538 0.737272 O\n0.885886 0.391960 0.794852 O\n0.964407 0.157184 0.769479 O\n",
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{
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{
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{
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{
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{
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{
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}