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{
"id": "mp-757858",
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{
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"structure_string": "Li4 Mn2 Si6 O16\n1.0\n-2.185410 4.519086 3.989209\n2.189078 -4.424012 3.919382\n7.915919 5.277978 -3.861335\nLi Mn Si O\n4 2 6 16\ndirect\n0.854567 0.785163 0.141193 Li\n0.854586 0.285165 0.641176 Li\n0.108857 0.689374 0.388696 Li\n0.108888 0.189393 0.888703 Li\n0.613983 0.085833 0.810805 Mn\n0.614007 0.585980 0.310874 Mn\n0.823147 0.259938 0.147260 Si\n0.823144 0.759927 0.647257 Si\n0.405148 0.931500 0.167672 Si\n0.405135 0.431473 0.667664 Si\n0.193163 0.250753 0.361740 Si\n0.193173 0.750768 0.861738 Si\n0.858637 0.648274 0.490148 O\n0.858634 0.148272 0.990151 O\n0.186445 0.796283 0.030073 O\n0.186440 0.296279 0.530074 O\n0.887558 0.543430 0.210972 O\n0.887562 0.043418 0.710968 O\n0.553335 0.763676 0.179325 O\n0.553334 0.263670 0.679323 O\n0.313460 0.494471 0.351930 O\n0.313483 0.994474 0.851924 O\n0.557362 0.174679 0.156474 O\n0.557356 0.674660 0.656452 O\n0.944656 0.148945 0.256124 O\n0.944658 0.648947 0.756121 O\n0.298238 0.026230 0.307581 O\n0.298239 0.526228 0.807580 O\n",
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{
"id": "mp-1223836",
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"structure_string": "In1 Ag1 Se2\n1.0\n4.043576 0.000000 0.000000\n0.000000 4.043576 0.000000\n0.000000 0.000000 5.647235\nIn Ag Se\n1 1 2\ndirect\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Ag\n0.000000 0.000000 0.500000 Se\n0.500000 0.500000 0.000000 Se\n",
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{
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"structure_string": "Cs2 Rb1 Sb1 F6\n1.0\n0.000000 4.927301 4.927301\n4.927301 0.000000 4.927301\n4.927301 4.927301 0.000000\nCs Rb Sb F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Sb\n0.775367 0.224633 0.224633 F\n0.224633 0.224633 0.775367 F\n0.224633 0.775367 0.775367 F\n0.224633 0.775367 0.224633 F\n0.775367 0.224633 0.775367 F\n0.775367 0.775367 0.224633 F\n",
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{
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"structure_string": "Sm4 B4 S12\n1.0\n6.048584 0.000000 0.000000\n0.000000 7.445420 0.000000\n0.000000 0.000000 8.879778\nSm B S\n4 4 12\ndirect\n0.936125 0.883236 0.758166 Sm\n0.563875 0.383236 0.758166 Sm\n0.436125 0.616764 0.258166 Sm\n0.063875 0.116764 0.258166 Sm\n0.400842 0.854939 0.928004 B\n0.599158 0.145061 0.428004 B\n0.099158 0.354939 0.928004 B\n0.900842 0.645061 0.428004 B\n0.666651 0.674589 0.555060 S\n0.635151 0.704338 0.957864 S\n0.864849 0.204338 0.957864 S\n0.135151 0.795662 0.457864 S\n0.833349 0.174589 0.555060 S\n0.891453 0.497508 0.267006 S\n0.108547 0.502492 0.767006 S\n0.391453 0.002492 0.767006 S\n0.608547 0.997508 0.267006 S\n0.333349 0.325411 0.055060 S\n0.364849 0.295662 0.457864 S\n0.166651 0.825411 0.055060 S\n",
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"density": 4.274794435605385,
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"formula_full": "Sm4 B4 S12",
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{
"id": "mp-1247231",
"created_at": "2022-09-04T14:41:03.965716Z",
"structure_string": "Lu3 Mg2 Ti1 S8\n1.0\n6.680947 -0.000503 3.856938\n2.226525 6.189171 3.856933\n0.000056 0.000027 7.713779\nLu Mg Ti S\n3 2 1 8\ndirect\n0.500008 0.500011 0.499975 Lu\n0.499999 0.499989 0.000003 Lu\n0.999995 0.499995 0.500013 Lu\n0.875167 0.874442 0.875236 Mg\n0.124822 0.125572 0.124776 Mg\n0.500008 0.000005 0.499990 Ti\n0.735268 0.758280 0.735431 S\n0.264731 0.241736 0.728964 S\n0.255709 0.732506 0.255885 S\n0.729033 0.241637 0.264662 S\n0.744275 0.267495 0.744105 S\n0.270975 0.758354 0.735339 S\n0.264739 0.241699 0.264585 S\n0.735277 0.758275 0.271038 S\n",
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{
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"structure_string": "Li4 Cu1 P6 O18\n1.0\n7.253590 0.000000 0.000000\n-3.005249 6.863088 0.000000\n-1.236528 -3.084332 6.898075\nLi Cu P O\n4 1 6 18\ndirect\n0.215908 0.062954 0.887175 Li\n0.628268 0.445649 0.839067 Li\n0.487194 0.998306 0.528157 Li\n0.363797 0.543016 0.150473 Li\n0.795699 0.943210 0.132679 Cu\n0.986935 0.315050 0.779496 P\n0.340297 0.686334 0.782710 P\n0.207328 0.262865 0.497722 P\n0.774942 0.722936 0.498939 P\n0.672945 0.319338 0.206848 P\n0.021657 0.700889 0.235347 P\n0.111466 0.282822 0.931823 O\n0.510255 0.691229 0.934693 O\n0.113988 0.564923 0.811602 O\n0.757888 0.256179 0.747871 O\n0.370710 0.220766 0.597974 O\n0.003564 0.200144 0.571136 O\n0.361453 0.885497 0.765454 O\n0.837326 0.813496 0.712760 O\n0.306726 0.520038 0.569875 O\n0.695598 0.465191 0.421944 O\n0.112021 0.161593 0.279090 O\n0.660962 0.115852 0.212002 O\n0.994260 0.800048 0.440345 O\n0.620876 0.758772 0.375295 O\n0.250938 0.769065 0.261868 O\n0.902786 0.449058 0.187409 O\n0.502721 0.314534 0.061622 O\n0.891492 0.730247 0.078623 O\n",
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{
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"structure_string": "Mn4 V4 N8\n1.0\n5.263798 0.000000 0.000000\n0.000000 6.046420 0.000000\n0.000000 0.000000 5.358848\nMn V N\n4 4 8\ndirect\n0.590839 0.871569 0.002954 Mn\n0.409161 0.128431 0.502954 Mn\n0.909161 0.371569 0.502954 Mn\n0.090839 0.628431 0.002954 Mn\n0.581920 0.372919 0.005064 V\n0.418080 0.627081 0.505064 V\n0.918080 0.872919 0.505064 V\n0.081920 0.127081 0.005064 V\n0.585440 0.876426 0.359765 N\n0.414560 0.123574 0.859765 N\n0.914560 0.376426 0.859765 N\n0.085440 0.623574 0.359765 N\n0.579061 0.377810 0.354219 N\n0.420939 0.622190 0.854219 N\n0.920939 0.877810 0.854219 N\n0.079061 0.122190 0.354219 N\n",
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{
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"structure_string": "Na8 Th4 P8 O32\n1.0\n10.968098 3.560291 0.000000\n-10.968098 3.560291 0.000000\n0.000000 3.348671 8.641467\nNa Th P O\n8 4 8 32\ndirect\n0.708519 0.088296 0.454888 Na\n0.312175 0.438265 0.992968 Na\n0.911704 0.291481 0.045112 Na\n0.561735 0.687825 0.507032 Na\n0.687825 0.561735 0.007032 Na\n0.088296 0.708519 0.954888 Na\n0.291481 0.911704 0.545112 Na\n0.438265 0.312175 0.492968 Na\n0.928201 0.071799 0.750000 Th\n0.071799 0.928201 0.250000 Th\n0.296234 0.703766 0.250000 Th\n0.703766 0.296234 0.750000 Th\n0.117439 0.249679 0.380336 P\n0.750321 0.882561 0.119664 P\n0.882561 0.750321 0.619664 P\n0.128546 0.507007 0.647628 P\n0.871454 0.492993 0.352372 P\n0.507007 0.128546 0.147628 P\n0.249679 0.117439 0.880336 P\n0.492993 0.871454 0.852372 P\n0.759512 0.658608 0.505094 O\n0.207219 0.183883 0.771518 O\n0.118106 0.953224 0.514185 O\n0.450271 0.944318 0.750252 O\n0.421730 0.160806 0.243803 O\n0.046776 0.881894 0.985815 O\n0.330424 0.707859 0.506147 O\n0.401590 0.157314 0.776552 O\n0.160806 0.421730 0.743803 O\n0.058116 0.667067 0.410271 O\n0.341392 0.240488 0.994906 O\n0.240488 0.341392 0.494906 O\n0.598410 0.842686 0.223448 O\n0.549729 0.055682 0.249748 O\n0.881894 0.046776 0.485815 O\n0.332933 0.941884 0.089729 O\n0.669576 0.292141 0.493853 O\n0.667067 0.058116 0.910271 O\n0.839194 0.578270 0.256197 O\n0.578270 0.839194 0.756197 O\n0.292141 0.669576 0.993853 O\n0.944318 0.450271 0.250252 O\n0.941884 0.332933 0.589729 O\n0.157314 0.401590 0.276552 O\n0.707859 0.330424 0.006147 O\n0.953224 0.118106 0.014185 O\n0.183883 0.207219 0.271518 O\n0.055682 0.549729 0.749748 O\n0.816117 0.792781 0.728482 O\n0.658608 0.759512 0.005094 O\n0.842686 0.598410 0.723448 O\n0.792781 0.816117 0.228482 O\n",
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