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{
"id": "mp-1195657",
"created_at": "2022-09-04T14:46:10.814342Z",
"structure_string": "Li4 Sb8 F28\n1.0\n4.906120 0.000000 0.000000\n0.000000 8.900484 0.000000\n0.000000 0.000000 14.674750\nLi Sb F\n4 8 28\ndirect\n0.868307 0.928955 0.250000 Li\n0.631693 0.428955 0.250000 Li\n0.131693 0.071045 0.750000 Li\n0.368307 0.571045 0.750000 Li\n0.312595 0.114025 0.398938 Sb\n0.187405 0.614025 0.101062 Sb\n0.687405 0.885975 0.898938 Sb\n0.812595 0.385975 0.601062 Sb\n0.687405 0.885975 0.601062 Sb\n0.812595 0.385975 0.898938 Sb\n0.312595 0.114025 0.101062 Sb\n0.187405 0.614025 0.398938 Sb\n0.617003 0.003532 0.342904 F\n0.882997 0.503532 0.157096 F\n0.382997 0.996468 0.842904 F\n0.117003 0.496468 0.657096 F\n0.382997 0.996468 0.657096 F\n0.117003 0.496468 0.842904 F\n0.617003 0.003532 0.157096 F\n0.882997 0.503532 0.342904 F\n0.452488 0.304030 0.346922 F\n0.047512 0.804030 0.153078 F\n0.547512 0.695970 0.846922 F\n0.952488 0.195970 0.653078 F\n0.547512 0.695970 0.653078 F\n0.952488 0.195970 0.846922 F\n0.452488 0.304030 0.153078 F\n0.047512 0.804030 0.346922 F\n0.593826 0.150958 0.498840 F\n0.906174 0.650958 0.001160 F\n0.406174 0.849042 0.998840 F\n0.093826 0.349042 0.501160 F\n0.406174 0.849042 0.501160 F\n0.093826 0.349042 0.998840 F\n0.593826 0.150958 0.001160 F\n0.906174 0.650958 0.498840 F\n0.146770 0.090227 0.250000 F\n0.353230 0.590227 0.250000 F\n0.853230 0.909773 0.750000 F\n0.646770 0.409773 0.750000 F\n",
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},
{
"id": "mp-1181886",
"created_at": "2022-09-04T14:46:24.452863Z",
"structure_string": "Ca4 Si4 O12\n1.0\n-3.609067 3.609067 3.609067\n3.609067 -3.609067 3.609067\n3.609067 3.609067 -3.609067\nCa Si O\n4 4 12\ndirect\n0.000000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.000000 Ca\n0.000000 0.500000 0.000000 Si\n0.000000 0.000000 0.500000 Si\n0.500000 0.500000 0.500000 Si\n0.500000 0.000000 0.000000 Si\n0.760796 0.260410 0.021206 O\n0.239204 0.739590 0.978794 O\n0.260410 0.499613 0.239204 O\n0.760796 0.739590 0.500387 O\n0.239204 0.260410 0.499613 O\n0.499613 0.239204 0.260410 O\n0.739590 0.500387 0.760796 O\n0.739590 0.978794 0.239204 O\n0.260410 0.021206 0.760796 O\n0.021206 0.760796 0.260410 O\n0.978794 0.239204 0.739590 O\n0.500387 0.760796 0.739590 O\n",
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"formula_full": "Ca4 Si4 O12",
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{
"id": "mp-695119",
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"structure_string": "Na6 Zr4 Si4 P2 O24\n1.0\n9.136713 0.000000 0.000000\n4.540978 7.963249 0.000000\n4.498411 2.561176 7.737935\nNa Zr Si P O\n6 4 4 2 24\ndirect\n0.053131 0.303255 0.909232 Na\n0.429686 0.012927 0.470794 Na\n0.615190 0.391138 0.245761 Na\n0.390266 0.599931 0.759147 Na\n0.936273 0.711579 0.107375 Na\n0.749493 0.910597 0.671047 Na\n0.159771 0.644862 0.552181 Zr\n0.644580 0.154592 0.054484 Zr\n0.354750 0.846180 0.945888 Zr\n0.851947 0.354692 0.438429 Zr\n0.252586 0.466861 0.237130 Si\n0.468786 0.247942 0.735680 Si\n0.533308 0.752128 0.264393 Si\n0.751981 0.533099 0.757024 Si\n0.044105 0.961679 0.743841 P\n0.953727 0.040550 0.252652 P\n0.106658 0.000826 0.086785 O\n0.007251 0.116246 0.582546 O\n0.067371 0.439116 0.293353 O\n0.269100 0.628195 0.051743 O\n0.425677 0.284024 0.226654 O\n0.253562 0.524694 0.378756 O\n0.049852 0.789232 0.743426 O\n0.427003 0.070875 0.789523 O\n0.287461 0.422670 0.722485 O\n0.475038 0.765779 0.115127 O\n0.776439 0.060459 0.249664 O\n0.372976 0.734305 0.450540 O\n0.637667 0.255947 0.556395 O\n0.224873 0.931874 0.748457 O\n0.521353 0.239627 0.886103 O\n0.713389 0.574166 0.274117 O\n0.585765 0.922234 0.210720 O\n0.936820 0.219440 0.248744 O\n0.749702 0.479855 0.613605 O\n0.579986 0.716990 0.774658 O\n0.738928 0.369500 0.941083 O\n0.931218 0.573522 0.701486 O\n0.993198 0.889187 0.416072 O\n0.893130 0.999228 0.910901 O\n",
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"formula_full": "Na6 Zr4 Si4 P2 O24",
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{
"id": "mp-699450",
"created_at": "2022-09-04T14:45:55.956542Z",
"structure_string": "Li8 H16 S8 N8 O24\n1.0\n5.184184 0.000000 0.000000\n0.000000 8.602452 0.000000\n0.000000 0.000000 16.957800\nLi H S N O\n8 16 8 8 24\ndirect\n0.449533 0.275226 0.402904 Li\n0.550467 0.775226 0.597096 Li\n0.449533 0.775226 0.097096 Li\n0.550467 0.275226 0.902904 Li\n0.958635 0.471642 0.347703 Li\n0.041365 0.971642 0.652297 Li\n0.958635 0.971642 0.152297 Li\n0.041365 0.471642 0.847703 Li\n0.200790 0.936111 0.383985 H\n0.799210 0.436111 0.616015 H\n0.200790 0.436111 0.116015 H\n0.799210 0.936111 0.883985 H\n0.485812 0.723653 0.297849 H\n0.514188 0.223653 0.702151 H\n0.485812 0.223653 0.202151 H\n0.514188 0.723653 0.797849 H\n0.860778 0.065105 0.514470 H\n0.139222 0.565105 0.485530 H\n0.860778 0.565105 0.985530 H\n0.139222 0.065105 0.014470 H\n0.887019 0.893283 0.385366 H\n0.112981 0.393283 0.614634 H\n0.887019 0.393283 0.114634 H\n0.112981 0.893283 0.885366 H\n0.485151 0.637580 0.415431 S\n0.514849 0.137580 0.584569 S\n0.485151 0.137580 0.084569 S\n0.514849 0.637580 0.915431 S\n0.950148 0.121380 0.330062 S\n0.049852 0.621380 0.669938 S\n0.950148 0.621380 0.169938 S\n0.049852 0.121380 0.830062 S\n0.497687 0.766490 0.354395 N\n0.502313 0.266490 0.645605 N\n0.497687 0.266490 0.145605 N\n0.502313 0.766490 0.854395 N\n0.018211 0.981508 0.394601 N\n0.981789 0.481508 0.605399 N\n0.018211 0.481508 0.105399 N\n0.981789 0.981508 0.894601 N\n0.175972 0.586570 0.429273 O\n0.824028 0.086570 0.570727 O\n0.175972 0.086570 0.070727 O\n0.824028 0.586570 0.929273 O\n0.564475 0.692401 0.492789 O\n0.435525 0.192401 0.507211 O\n0.564475 0.192401 0.007211 O\n0.435525 0.692401 0.992789 O\n0.603267 0.486433 0.392388 O\n0.396733 0.986433 0.607612 O\n0.603267 0.986433 0.107612 O\n0.396733 0.486433 0.892388 O\n0.674180 0.150183 0.339578 O\n0.325820 0.650183 0.660422 O\n0.674180 0.650183 0.160422 O\n0.325820 0.150183 0.839578 O\n0.105967 0.257155 0.355363 O\n0.894033 0.757155 0.644637 O\n0.105967 0.757155 0.144637 O\n0.894033 0.257155 0.855363 O\n0.019826 0.072379 0.250201 O\n0.980174 0.572379 0.749799 O\n0.019826 0.572379 0.249799 O\n0.980174 0.072379 0.750201 O\n",
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"formula_full": "Li8 H16 S8 N8 O24",
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{
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"structure_string": "Hg3 Te3\n1.0\n2.357628 -4.083532 0.000000\n2.357628 4.083532 0.000000\n0.000000 0.000000 10.413739\nHg Te\n3 3\ndirect\n0.329171 0.329171 0.000000 Hg\n0.000000 0.670829 0.666667 Hg\n0.670829 0.000000 0.333333 Hg\n0.482087 0.482087 0.500000 Te\n0.000000 0.517913 0.166667 Te\n0.517913 0.000000 0.833333 Te\n",
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{
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"structure_string": "K1 La1 Y1 Nb1 O6\n1.0\n-0.000000 -4.210130 -4.210130\n4.210130 0.000000 -4.210130\n4.210130 -4.210130 -0.000000\nK La Y Nb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 La\n0.500000 0.500000 0.500000 Y\n-0.000000 -0.000000 0.000000 Nb\n0.762301 0.237699 0.237699 O\n0.237699 0.762301 0.762301 O\n0.762301 0.237699 0.762301 O\n0.237699 0.762301 0.237699 O\n0.762301 0.762301 0.237699 O\n0.237699 0.237699 0.762301 O\n",
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{
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"structure_string": "Mg1 P4 Br12 O4\n1.0\n7.537801 0.495277 0.617068\n0.730123 11.095926 0.148259\n1.060455 0.114875 9.791623\nMg P Br O\n1 4 12 4\ndirect\n0.861515 0.416449 0.967436 Mg\n0.438004 0.261277 0.278128 P\n0.620323 0.684575 0.729887 P\n0.807581 0.188389 0.771678 P\n0.104980 0.813705 0.240914 P\n0.768326 0.625863 0.525759 Br\n0.889867 0.968800 0.271951 Br\n0.268901 0.834000 0.399785 Br\n0.647801 0.083541 0.929204 Br\n0.266139 0.374161 0.461466 Br\n0.841492 0.654233 0.863742 Br\n0.436006 0.551821 0.812744 Br\n0.694372 0.189067 0.585490 Br\n0.078072 0.086231 0.727795 Br\n0.180282 0.373375 0.979424 Br\n0.282576 0.853607 0.044331 Br\n0.621775 0.451536 0.177178 Br\n0.539968 0.813219 0.737871 O\n0.810666 0.313541 0.823093 O\n0.573741 0.174033 0.335652 O\n0.038448 0.694825 0.242867 O\n",
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{
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{
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"structure_string": "Rb4 Fe4 O8\n1.0\n-0.000005 5.931971 0.000010\n0.000002 0.000014 8.120472\n5.961922 -0.000005 0.000002\nRb Fe O\n4 4 8\ndirect\n0.014176 0.622316 0.063509 Rb\n0.514179 0.122315 0.436490 Rb\n0.014176 0.877685 0.563486 Rb\n0.514177 0.377685 0.936514 Rb\n0.000787 0.373679 0.546936 Fe\n0.500786 0.873679 0.953062 Fe\n0.000789 0.126322 0.046926 Fe\n0.500789 0.626320 0.453077 Fe\n0.702947 0.048797 0.007066 O\n0.202948 0.548797 0.492934 O\n0.702909 0.451221 0.507067 O\n0.202910 0.951221 0.992933 O\n0.542225 0.694262 0.151626 O\n0.042225 0.194261 0.348374 O\n0.542229 0.805720 0.651588 O\n0.042230 0.305721 0.848412 O\n",
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