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{
"id": "mp-769001",
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"structure_string": "Li12 Sn4 B8 S2 O32\n1.0\n0.000000 6.764726 6.764726\n6.764726 0.000000 6.764726\n6.764726 6.764726 0.000000\nLi Sn B S O\n12 4 8 2 32\ndirect\n0.216599 0.216599 0.783401 Li\n0.783401 0.216599 0.216599 Li\n0.783401 0.216599 0.783401 Li\n0.216599 0.783401 0.216599 Li\n0.466599 0.466599 0.033401 Li\n0.033401 0.466599 0.466599 Li\n0.216599 0.783401 0.783401 Li\n0.783401 0.783401 0.216599 Li\n0.033401 0.466599 0.033401 Li\n0.466599 0.033401 0.466599 Li\n0.033401 0.033401 0.466599 Li\n0.466599 0.033401 0.033401 Li\n0.625000 0.125000 0.625000 Sn\n0.625000 0.625000 0.125000 Sn\n0.125000 0.625000 0.625000 Sn\n0.625000 0.625000 0.625000 Sn\n0.403123 0.403123 0.403123 B\n0.790630 0.403123 0.403123 B\n0.403123 0.403123 0.790630 B\n0.403123 0.790630 0.403123 B\n0.846877 0.459370 0.846877 B\n0.846877 0.846877 0.459370 B\n0.459370 0.846877 0.846877 B\n0.846877 0.846877 0.846877 B\n0.250000 0.250000 0.250000 S\n0.000000 0.000000 0.000000 S\n0.186040 0.186040 0.186040 O\n0.186040 0.186040 0.441880 O\n0.441880 0.186040 0.186040 O\n0.186040 0.441880 0.186040 O\n0.412731 0.254044 0.542888 O\n0.542888 0.412731 0.254044 O\n0.790338 0.254044 0.412731 O\n0.254044 0.542888 0.412731 O\n0.542888 0.254044 0.790338 O\n0.254044 0.412731 0.790338 O\n0.790338 0.542888 0.254044 O\n0.790338 0.412731 0.542888 O\n0.412731 0.790338 0.254044 O\n0.412731 0.542888 0.790338 O\n0.254044 0.790338 0.542888 O\n0.707112 0.459662 0.837269 O\n0.542888 0.790338 0.412731 O\n0.995956 0.459662 0.707112 O\n0.837269 0.707112 0.459662 O\n0.837269 0.459662 0.995956 O\n0.459662 0.837269 0.707112 O\n0.459662 0.707112 0.995956 O\n0.995956 0.837269 0.459662 O\n0.707112 0.995956 0.459662 O\n0.995956 0.707112 0.837269 O\n0.459662 0.995956 0.837269 O\n0.707112 0.837269 0.995956 O\n0.837269 0.995956 0.707112 O\n0.063960 0.808120 0.063960 O\n0.063960 0.063960 0.808120 O\n0.808120 0.063960 0.063960 O\n0.063960 0.063960 0.063960 O\n",
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"formula_full": "Li12 Sn4 B8 S2 O32",
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"updated_at": "2021-11-28T01:35:44.248000Z",
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},
{
"id": "mp-770884",
"created_at": "2022-09-04T14:46:08.308799Z",
"structure_string": "Li4 Sn2 C2 S2 O14\n1.0\n6.828448 0.000000 0.000000\n0.000000 5.109792 0.000000\n0.000000 0.038953 9.526902\nLi Sn C S O\n4 2 2 2 14\ndirect\n0.526353 0.780801 0.818669 Li\n0.973647 0.780801 0.818669 Li\n0.473647 0.219199 0.181331 Li\n0.026353 0.219199 0.181331 Li\n0.250000 0.233504 0.626211 Sn\n0.750000 0.766496 0.373789 Sn\n0.250000 0.232155 0.914024 C\n0.750000 0.767845 0.085976 C\n0.750000 0.231775 0.636577 S\n0.250000 0.768225 0.363423 S\n0.750000 0.773898 0.952703 O\n0.250000 0.013527 0.839553 O\n0.250000 0.451944 0.841768 O\n0.925524 0.085118 0.690062 O\n0.574476 0.085118 0.690062 O\n0.250000 0.772960 0.520630 O\n0.750000 0.502844 0.687901 O\n0.250000 0.497156 0.312099 O\n0.750000 0.227040 0.479370 O\n0.425524 0.914882 0.309938 O\n0.074476 0.914882 0.309938 O\n0.750000 0.548056 0.158232 O\n0.750000 0.986473 0.160447 O\n0.250000 0.226102 0.047297 O\n",
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"formula_full": "Li4 Sn2 C2 S2 O14",
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{
"id": "mp-1195382",
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"structure_string": "Li4 Sn2 H28 Se6 O14\n1.0\n7.559669 0.000000 0.000000\n2.540614 9.225844 0.000000\n3.404835 1.513295 10.046058\nLi Sn H Se O\n4 2 28 6 14\ndirect\n0.690092 0.085574 0.217874 Li\n0.309908 0.914426 0.782126 Li\n0.057164 0.256202 0.130387 Li\n0.942836 0.743798 0.869613 Li\n0.592077 0.375427 0.623049 Sn\n0.407923 0.624573 0.376951 Sn\n0.792138 0.223671 0.343158 H\n0.207862 0.776329 0.656842 H\n0.227078 0.437127 0.195580 H\n0.772922 0.562873 0.804420 H\n0.376384 0.023530 0.396409 H\n0.623616 0.976470 0.603591 H\n0.892311 0.822703 0.164786 H\n0.107689 0.177297 0.835214 H\n0.689424 0.056697 0.981156 H\n0.310576 0.943303 0.018844 H\n0.223828 0.007183 0.227144 H\n0.776172 0.992817 0.772856 H\n0.002113 0.405331 0.900589 H\n0.997887 0.594669 0.099411 H\n0.599863 0.223023 0.991760 H\n0.400137 0.776977 0.008240 H\n0.397323 0.175451 0.417877 H\n0.602677 0.824549 0.582123 H\n0.705070 0.337941 0.232635 H\n0.294930 0.662059 0.767365 H\n0.213214 0.349388 0.904233 H\n0.786786 0.650612 0.095767 H\n0.016699 0.444015 0.287337 H\n0.983301 0.555985 0.712663 H\n0.376852 0.090339 0.121457 H\n0.623148 0.909661 0.878543 H\n0.944416 0.862096 0.282776 H\n0.055584 0.137904 0.717224 H\n0.715358 0.597566 0.454826 Se\n0.284642 0.402434 0.545174 Se\n0.485851 0.444339 0.852837 Se\n0.514149 0.555661 0.147163 Se\n0.831538 0.144707 0.568046 Se\n0.168462 0.855293 0.431954 Se\n0.797028 0.243306 0.247134 O\n0.202972 0.756694 0.752866 O\n0.623321 0.125919 0.046937 O\n0.376679 0.874081 0.953063 O\n0.452636 0.100245 0.359417 O\n0.547364 0.899755 0.640583 O\n0.876039 0.902817 0.214795 O\n0.123961 0.097183 0.785205 O\n0.100007 0.423835 0.198879 O\n0.899993 0.576165 0.801121 O\n0.087473 0.318782 0.935717 O\n0.912527 0.681218 0.064283 O\n0.247982 0.070496 0.138554 O\n0.752018 0.929504 0.861446 O\n",
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],
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"formula_full": "Li4 Sn2 H28 Se6 O14",
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{
"id": "mp-768159",
"created_at": "2022-09-04T14:46:37.156107Z",
"structure_string": "Li2 Sn2 P2 C2 O14\n1.0\n6.548304 0.000000 0.000000\n0.000000 5.234350 0.000000\n0.000000 0.615862 8.935639\nLi Sn P C O\n2 2 2 2 14\ndirect\n0.468759 0.765169 0.838405 Li\n0.968759 0.234831 0.161595 Li\n0.248275 0.211145 0.657616 Sn\n0.748275 0.788855 0.342384 Sn\n0.750988 0.269309 0.571492 P\n0.250988 0.730691 0.428508 P\n0.259810 0.272802 0.938347 C\n0.759810 0.727198 0.061653 C\n0.729873 0.690618 0.928338 O\n0.262279 0.042983 0.881211 O\n0.283320 0.463896 0.830555 O\n0.937151 0.197427 0.670204 O\n0.564426 0.170474 0.662549 O\n0.259347 0.848158 0.583341 O\n0.737922 0.566164 0.538822 O\n0.237922 0.433836 0.461178 O\n0.759347 0.151842 0.416659 O\n0.064426 0.829526 0.337451 O\n0.437151 0.802573 0.329796 O\n0.783320 0.536104 0.169445 O\n0.762279 0.957017 0.118789 O\n0.229873 0.309382 0.071662 O\n",
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{
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"structure_string": "Li2 Sn2 P2 C2 O14\n1.0\n6.581086 0.000000 0.000000\n0.000000 5.096191 0.000000\n0.000000 0.712868 8.483545\nLi Sn P C O\n2 2 2 2 14\ndirect\n0.250000 0.757359 0.092626 Li\n0.750000 0.242641 0.907374 Li\n0.750000 0.801745 0.323234 Sn\n0.250000 0.198255 0.676766 Sn\n0.250000 0.719695 0.419498 P\n0.750000 0.280305 0.580502 P\n0.750000 0.698617 0.034976 C\n0.250000 0.301383 0.965024 C\n0.750000 0.948187 0.076919 O\n0.250000 0.363343 0.103341 O\n0.750000 0.521317 0.158542 O\n0.067191 0.796010 0.309867 O\n0.432809 0.796010 0.309867 O\n0.750000 0.145076 0.425179 O\n0.250000 0.419181 0.466160 O\n0.750000 0.580819 0.533840 O\n0.250000 0.854924 0.574821 O\n0.567191 0.203990 0.690133 O\n0.932809 0.203990 0.690133 O\n0.250000 0.478683 0.841458 O\n0.750000 0.636657 0.896659 O\n0.250000 0.051813 0.923081 O\n",
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{
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"formula_full": "Li1 Sn2 P4 H3 O16",
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{
"id": "mp-753239",
"created_at": "2022-09-04T14:48:16.421198Z",
"structure_string": "Li2 Sn2 P2 H2 O10\n1.0\n5.925812 -0.108485 0.093093\n-2.437245 7.757407 0.206424\n-0.667920 -1.982073 4.731439\nLi Sn P H O\n2 2 2 2 10\ndirect\n0.399116 0.824072 0.749908 Li\n0.600884 0.175928 0.250092 Li\n0.000000 0.500000 0.000000 Sn\n0.000000 0.000000 0.000000 Sn\n0.354629 0.220263 0.649675 P\n0.645371 0.779737 0.350325 P\n0.047911 0.300209 0.372323 H\n0.952089 0.699791 0.627677 H\n0.065148 0.760681 0.819913 O\n0.216485 0.352911 0.677270 O\n0.376337 0.691396 0.356729 O\n0.240872 0.049644 0.362733 O\n0.336107 0.135947 0.889735 O\n0.663893 0.864053 0.110265 O\n0.759128 0.950356 0.637267 O\n0.623663 0.308604 0.643271 O\n0.783515 0.647089 0.322730 O\n0.934852 0.239319 0.180087 O\n",
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{
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"structure_string": "Li2 Sn2 P2 H2 O10\n1.0\n5.173127 0.000000 0.000000\n-0.638392 5.893058 0.000000\n-2.065982 -3.035284 7.204063\nLi Sn P H O\n2 2 2 2 10\ndirect\n0.250092 0.600884 0.824072 Li\n0.749908 0.399116 0.175928 Li\n0.000000 0.000000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.350325 0.645371 0.220263 P\n0.649675 0.354629 0.779737 P\n0.627677 0.952089 0.300209 H\n0.372323 0.047911 0.699791 H\n0.180087 0.934852 0.760681 O\n0.322730 0.783515 0.352911 O\n0.643271 0.623663 0.691396 O\n0.637267 0.759128 0.049644 O\n0.110265 0.663893 0.135947 O\n0.889735 0.336107 0.864053 O\n0.362733 0.240872 0.950356 O\n0.356729 0.376337 0.308604 O\n0.677270 0.216485 0.647089 O\n0.819913 0.065148 0.239319 O\n",
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{
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"formula_full": "Li1 Sn2 P4 H3 O16",
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"spacegroup": 1
},
{
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"structure_string": "Li2 Sn2 P2 H2 O10\n1.0\n5.173127 0.000000 0.000000\n-0.638392 5.893058 0.000000\n-2.065982 -3.035284 7.204063\nLi Sn P H O\n2 2 2 2 10\ndirect\n0.426020 0.776812 0.824072 Li\n0.573980 0.223188 0.175928 Li\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.130062 0.425108 0.220263 P\n0.869938 0.574892 0.779737 P\n0.327468 0.651880 0.300209 H\n0.672532 0.348120 0.699791 H\n0.419406 0.174171 0.760681 O\n0.969819 0.430604 0.352911 O\n0.951875 0.932267 0.691396 O\n0.587622 0.709484 0.049644 O\n0.974319 0.527946 0.135947 O\n0.025681 0.472054 0.864053 O\n0.412378 0.290516 0.950356 O\n0.048125 0.067733 0.308604 O\n0.030181 0.569396 0.647089 O\n0.580594 0.825829 0.239319 O\n",
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"formula_full": "Li2 Sn2 P2 H2 O10",
"formula_reduced": "LiSnPHO5",
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},
{
"id": "mp-777312",
"created_at": "2022-09-04T14:41:46.986626Z",
"structure_string": "Li4 Sn2 P4 H3 O16\n1.0\n4.945180 0.000000 0.000000\n-1.518707 8.003048 0.000000\n-0.223345 -0.152250 8.908622\nLi Sn P H O\n4 2 4 3 16\ndirect\n0.107076 0.684478 0.652404 Li\n0.404259 0.841784 0.125680 Li\n0.614343 0.154413 0.866212 Li\n0.877403 0.311270 0.345612 Li\n0.999010 0.505946 0.995649 Sn\n0.494695 0.994570 0.501322 Sn\n0.126947 0.274060 0.666227 P\n0.363779 0.230213 0.141657 P\n0.620043 0.774644 0.854632 P\n0.873951 0.722609 0.329981 P\n0.461214 0.491879 0.639872 H\n0.534302 0.514602 0.380434 H\n0.041219 0.022085 0.019656 H\n0.056296 0.795502 0.464788 O\n0.966146 0.305947 0.807514 O\n0.131784 0.331315 0.173202 O\n0.267340 0.461261 0.607041 O\n0.409885 0.672598 0.964283 O\n0.476682 0.797365 0.702382 O\n0.228017 0.047872 0.074156 O\n0.358459 0.178575 0.700440 O\n0.639912 0.815745 0.295497 O\n0.740665 0.943680 0.931747 O\n0.512177 0.196713 0.286872 O\n0.559385 0.316773 0.022264 O\n0.735580 0.532818 0.382706 O\n0.847901 0.666577 0.821786 O\n0.043340 0.694751 0.191557 O\n0.937076 0.201856 0.534527 O\n",
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],
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"volume_molar": 7.32151509588938,
"formula_full": "Li4 Sn2 P4 H3 O16",
"formula_reduced": "Li4Sn2P4H3O16",
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"updated_at": "2021-11-28T01:35:21.970000Z",
"spacegroup": 1
},
{
"id": "mp-761694",
"created_at": "2022-09-04T14:42:03.498106Z",
"structure_string": "Li1 Sn3 Sb1 P6 O24\n1.0\n8.753489 0.000000 0.000000\n-4.361752 7.592278 0.000000\n-4.363312 -2.525253 7.193519\nLi Sn Sb P O\n1 3 1 6 24\ndirect\n0.990795 0.498837 0.504242 Li\n0.718633 0.857346 0.583722 Sn\n0.289761 0.644011 0.928710 Sn\n0.714990 0.354072 0.074844 Sn\n0.281475 0.139324 0.420510 Sb\n0.794374 0.255344 0.747807 P\n0.209181 0.955289 0.748293 P\n0.500420 0.455541 0.253707 P\n0.495159 0.535804 0.748951 P\n0.791043 0.038225 0.247885 P\n0.212724 0.749837 0.260246 P\n0.612698 0.609437 0.428287 O\n0.206762 0.709968 0.086420 O\n0.788822 0.983478 0.411292 O\n0.828798 0.100946 0.747333 O\n0.368134 0.481340 0.072167 O\n0.574161 0.194694 0.569199 O\n0.021817 0.925761 0.747651 O\n0.963785 0.429332 0.736472 O\n0.592547 0.885014 0.059228 O\n0.196551 0.771808 0.733547 O\n0.335206 0.262146 0.247725 O\n0.310100 0.534868 0.733957 O\n0.193238 0.001238 0.571867 O\n0.678958 0.446330 0.265706 O\n0.812224 0.225600 0.262777 O\n0.658746 0.723493 0.755434 O\n0.416007 0.111688 0.929347 O\n0.379143 0.378125 0.569475 O\n0.029600 0.581222 0.261200 O\n0.986143 0.070924 0.253884 O\n0.420429 0.805191 0.442292 O\n0.619709 0.502881 0.927332 O\n0.179726 0.910162 0.253426 O\n0.812893 0.301630 0.926923 O\n",
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],
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"formula_full": "Li1 Sn3 Sb1 P6 O24",
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}
]
}