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{
"id": "mp-1173638",
"created_at": "2022-09-04T14:41:12.349078Z",
"structure_string": "Sr10 Cu1 Ru4 O20\n1.0\n-4.353672 4.353672 6.408125\n4.353672 -4.353672 6.408125\n4.353672 4.353672 -6.408125\nSr Cu Ru O\n10 1 4 20\ndirect\n0.757098 0.146520 0.195342 Sr\n0.351136 0.351136 0.000000 Sr\n0.951178 0.561755 0.804658 Sr\n0.561755 0.757098 0.610577 Sr\n0.146520 0.951178 0.389423 Sr\n0.648864 0.648864 0.000000 Sr\n0.242902 0.853480 0.804658 Sr\n0.853480 0.048822 0.610577 Sr\n0.438245 0.242902 0.389423 Sr\n0.048822 0.438245 0.195342 Sr\n0.000000 0.000000 0.000000 Cu\n0.596145 0.199794 0.795939 Ru\n0.199794 0.403855 0.603648 Ru\n0.800206 0.596145 0.396352 Ru\n0.403855 0.800206 0.204061 Ru\n0.562642 0.961796 0.200095 O\n0.162269 0.162269 0.000000 O\n0.761701 0.362547 0.799905 O\n0.362547 0.562642 0.600846 O\n0.961796 0.761701 0.399154 O\n0.837731 0.837731 0.000000 O\n0.437358 0.038204 0.799905 O\n0.038204 0.238299 0.600846 O\n0.637453 0.437358 0.399154 O\n0.238299 0.637453 0.200095 O\n0.695343 0.395924 0.091267 O\n0.304657 0.604076 0.908733 O\n0.896259 0.792435 0.688694 O\n0.500000 0.000000 0.500000 O\n0.103741 0.207565 0.311306 O\n0.000000 0.500000 0.500000 O\n0.604076 0.695343 0.299420 O\n0.207565 0.896259 0.103824 O\n0.792435 0.103741 0.896176 O\n0.395924 0.304657 0.700580 O\n",
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},
{
"id": "mp-1196439",
"created_at": "2022-09-04T14:41:12.431735Z",
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0.669481 H\n0.876541 0.668254 0.830519 H\n0.925000 0.182861 0.561744 H\n0.575000 0.682861 0.938256 H\n0.425000 0.817139 0.438256 H\n0.075000 0.317139 0.061744 H\n0.075000 0.817139 0.438256 H\n0.425000 0.317139 0.061744 H\n0.575000 0.182861 0.561744 H\n0.925000 0.682861 0.938256 H\n0.937373 0.551299 0.622014 H\n0.562627 0.051299 0.877986 H\n0.437373 0.448701 0.377986 H\n0.062627 0.948701 0.122014 H\n0.062627 0.448701 0.377986 H\n0.437373 0.948701 0.122014 H\n0.562627 0.551299 0.622014 H\n0.937373 0.051299 0.877986 H\n0.927859 0.658633 0.552269 H\n0.572141 0.158633 0.947731 H\n0.427859 0.341367 0.447731 H\n0.072141 0.841367 0.052269 H\n0.072141 0.341367 0.447731 H\n0.427859 0.841367 0.052269 H\n0.572141 0.658633 0.552269 H\n0.927859 0.158633 0.947731 H\n0.872708 0.661180 0.658371 H\n0.627292 0.161180 0.841629 H\n0.372708 0.338820 0.341629 H\n0.127292 0.838820 0.158371 H\n0.127292 0.338820 0.341629 H\n0.372708 0.838820 0.158371 H\n0.627292 0.661180 0.658371 H\n0.872708 0.161180 0.841629 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C\n0.841449 0.437817 0.988913 C\n0.880502 0.977688 0.296985 C\n0.619498 0.477688 0.203015 C\n0.380502 0.022312 0.703015 C\n0.119498 0.522312 0.796985 C\n0.119498 0.022312 0.703015 C\n0.380502 0.522312 0.796985 C\n0.619498 0.977688 0.296985 C\n0.880502 0.477688 0.203015 C\n0.891269 0.221567 0.617087 C\n0.608731 0.721567 0.882913 C\n0.391269 0.778433 0.382913 C\n0.108731 0.278433 0.117087 C\n0.108731 0.778433 0.382913 C\n0.391269 0.278433 0.117087 C\n0.608731 0.221567 0.617087 C\n0.891269 0.721567 0.882913 C\n0.889797 0.614152 0.602158 C\n0.610203 0.114152 0.897842 C\n0.389797 0.385848 0.397842 C\n0.110203 0.885848 0.102158 C\n0.110203 0.385848 0.397842 C\n0.389797 0.885848 0.102158 C\n0.610203 0.614152 0.602158 C\n0.889797 0.114152 0.897842 C\n0.856967 0.064811 0.350249 N\n0.643033 0.564811 0.149751 N\n0.356967 0.935189 0.649751 N\n0.143033 0.435189 0.850249 N\n0.143033 0.935189 0.649751 N\n0.356967 0.435189 0.850249 N\n0.643033 0.064811 0.350249 N\n0.856967 0.564811 0.149751 N\n0.750000 0.974473 0.467871 N\n0.750000 0.474473 0.032129 N\n0.250000 0.025527 0.532129 N\n0.250000 0.525527 0.967871 N\n0.750000 0.412276 0.707878 Cl\n0.750000 0.912276 0.792122 Cl\n0.250000 0.587724 0.292122 Cl\n0.250000 0.087724 0.207878 Cl\n0.750000 0.660310 0.414923 Cl\n0.750000 0.160310 0.085077 Cl\n0.250000 0.339690 0.585077 Cl\n0.250000 0.839690 0.914923 Cl\n0.750000 0.177196 0.451083 O\n0.750000 0.677196 0.048917 O\n0.250000 0.822804 0.548917 O\n0.250000 0.322804 0.951083 O\n",
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"formula_full": "Sn8 P4 H128 C44 N12 Cl8 O4",
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{
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"structure_string": "Mn6 P8 O32\n1.0\n8.115663 0.000000 -1.436551\n0.000000 13.370080 0.000000\n0.098239 0.000000 5.927436\nMn P O\n6 8 32\ndirect\n0.286279 0.562607 0.191470 Mn\n0.713721 0.062607 0.308530 Mn\n0.685573 0.794395 0.872025 Mn\n0.726080 0.429310 0.847966 Mn\n0.273920 0.929310 0.652034 Mn\n0.314427 0.294395 0.627975 Mn\n0.089723 0.121818 0.355057 P\n0.427685 0.596770 0.730410 P\n0.886907 0.872765 0.620672 P\n0.572315 0.096770 0.769590 P\n0.581929 0.408937 0.326666 P\n0.910277 0.621818 0.144943 P\n0.113093 0.372765 0.879328 P\n0.418071 0.908937 0.173334 P\n0.341835 0.869037 0.378149 O\n0.830529 0.942655 0.415065 O\n0.495383 0.012975 0.244709 O\n0.691577 0.113228 0.595613 O\n0.847102 0.553638 0.942688 O\n0.658165 0.369037 0.121851 O\n0.108016 0.078262 0.122184 O\n0.511933 0.493991 0.769594 O\n0.488067 0.993991 0.730406 O\n0.459149 0.187713 0.757079 O\n0.504618 0.512975 0.255291 O\n0.540851 0.687713 0.742921 O\n0.906056 0.147134 0.354551 O\n0.069737 0.850228 0.621010 O\n0.454962 0.337215 0.401457 O\n0.833926 0.909617 0.850121 O\n0.169471 0.442655 0.084935 O\n0.214305 0.272663 0.897720 O\n0.310873 0.602526 0.497450 O\n0.152898 0.053638 0.557312 O\n0.891984 0.578262 0.377816 O\n0.930263 0.350228 0.878990 O\n0.093944 0.647134 0.145449 O\n0.185559 0.222046 0.374502 O\n0.785695 0.772663 0.602280 O\n0.545038 0.837215 0.098543 O\n0.728485 0.420022 0.525592 O\n0.689127 0.102526 0.002550 O\n0.308423 0.613228 0.904387 O\n0.166074 0.409617 0.649879 O\n0.271515 0.920022 0.974408 O\n0.814441 0.722046 0.125498 O\n",
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{
"id": "mp-1235676",
"created_at": "2022-09-04T14:41:12.472903Z",
"structure_string": "Li1 Cu6 O1 F11\n1.0\n2.606006 0.081662 -4.724213\n0.001356 4.761072 -0.082249\n7.292466 -0.081904 4.873919\nLi Cu O F\n1 6 1 11\ndirect\n0.349155 0.018183 0.855264 Li\n0.954719 0.989593 0.018274 Cu\n0.459309 0.552012 0.061519 Cu\n0.348550 0.985864 0.332264 Cu\n0.830663 0.504739 0.333238 Cu\n0.200753 0.493484 0.655497 Cu\n0.713472 0.006564 0.651157 Cu\n0.545951 0.702471 0.255549 O\n0.272210 0.187327 0.055693 F\n0.057381 0.790403 0.251420 F\n0.779314 0.299830 0.101820 F\n0.133723 0.284824 0.408063 F\n0.629689 0.192004 0.418038 F\n0.400563 0.805120 0.608761 F\n0.901310 0.689780 0.571731 F\n0.499049 0.298153 0.743490 F\n0.166002 0.705411 0.914855 F\n0.016157 0.188209 0.734297 F\n0.654532 0.819915 0.927507 F\n",
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{
"id": "mp-1105814",
"created_at": "2022-09-04T14:41:12.485566Z",
"structure_string": "Tl8 Sn2 Se6\n1.0\n-8.513845 0.000000 0.000000\n0.000000 8.513845 0.000000\n4.256923 -4.256923 -6.451333\nTl Sn Se\n8 2 6\ndirect\n0.005977 0.805036 0.311012 Tl\n0.305036 0.505977 0.311012 Tl\n0.805036 0.305036 0.311012 Tl\n0.505977 0.005977 0.311012 Tl\n0.994023 0.194964 0.688988 Tl\n0.694964 0.494023 0.688988 Tl\n0.194964 0.694964 0.688988 Tl\n0.494023 0.994023 0.688988 Tl\n0.500000 0.500000 0.000000 Sn\n0.000000 0.000000 0.000000 Sn\n0.750000 0.750000 0.500000 Se\n0.250000 0.250000 0.500000 Se\n0.665010 0.834990 0.000000 Se\n0.334990 0.165010 0.000000 Se\n0.834990 0.334990 0.000000 Se\n0.165010 0.665010 0.000000 Se\n",
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"formula_full": "Tl8 Sn2 Se6",
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{
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