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{
"id": "mp-1519678",
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{
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"structure_string": "Li12 Ti8 P12 O48\n1.0\n8.830792 0.000000 0.000000\n0.000000 8.799296 0.000000\n0.000000 8.733461 12.241898\nLi Ti P O\n12 8 12 48\ndirect\n0.934801 0.349865 0.707483 Li\n0.225029 0.032139 0.179048 Li\n0.270088 0.383750 0.820296 Li\n0.770088 0.616250 0.679704 Li\n0.725029 0.967861 0.320952 Li\n0.434801 0.650135 0.792517 Li\n0.565199 0.349865 0.207483 Li\n0.274971 0.032139 0.679048 Li\n0.229912 0.383750 0.320296 Li\n0.729912 0.616250 0.179704 Li\n0.774971 0.967861 0.820952 Li\n0.065199 0.650135 0.292517 Li\n0.459256 0.632848 0.607919 Ti\n0.959256 0.367152 0.892081 Ti\n0.541102 0.134676 0.110781 Ti\n0.041102 0.865324 0.389219 Ti\n0.958898 0.134676 0.610781 Ti\n0.458898 0.865324 0.889219 Ti\n0.040744 0.632848 0.107919 Ti\n0.540744 0.367152 0.392081 Ti\n0.755008 0.543938 0.500322 P\n0.608747 0.255663 0.850519 P\n0.895135 0.957915 0.148229 P\n0.395135 0.042085 0.351771 P\n0.108747 0.744337 0.649481 P\n0.255008 0.456062 0.999678 P\n0.744992 0.543938 0.000322 P\n0.891253 0.255663 0.350519 P\n0.604865 0.957915 0.648229 P\n0.104865 0.042085 0.851771 P\n0.391253 0.744337 0.149481 P\n0.244992 0.456062 0.499678 P\n0.128907 0.615463 0.429388 O\n0.335009 0.482323 0.576833 O\n0.107641 0.219802 0.850656 O\n0.407143 0.898634 0.168068 O\n0.656723 0.549756 0.584072 O\n0.584554 0.177004 0.971071 O\n0.772496 0.339105 0.813070 O\n0.020214 0.915923 0.234013 O\n0.835017 0.737735 0.429258 O\n0.739680 0.985476 0.183995 O\n0.943825 0.131383 0.036548 O\n0.489048 0.415762 0.782366 O\n0.989048 0.584238 0.717634 O\n0.443825 0.868617 0.463452 O\n0.239680 0.014524 0.316005 O\n0.335017 0.262265 0.070742 O\n0.520214 0.084077 0.265987 O\n0.272496 0.660895 0.686930 O\n0.084554 0.822996 0.528929 O\n0.156723 0.450244 0.915928 O\n0.607641 0.780198 0.649344 O\n0.907143 0.101366 0.331932 O\n0.835009 0.517677 0.923167 O\n0.628907 0.384537 0.070612 O\n0.371093 0.615463 0.929388 O\n0.164991 0.482323 0.076833 O\n0.092857 0.898634 0.668068 O\n0.392359 0.219802 0.350656 O\n0.843277 0.549756 0.084072 O\n0.915446 0.177004 0.471071 O\n0.727504 0.339105 0.313070 O\n0.479786 0.915923 0.734013 O\n0.664983 0.737735 0.929258 O\n0.760320 0.985476 0.683995 O\n0.556175 0.131383 0.536548 O\n0.010952 0.415762 0.282366 O\n0.510952 0.584238 0.217634 O\n0.056175 0.868617 0.963452 O\n0.260320 0.014524 0.816005 O\n0.164983 0.262265 0.570742 O\n0.979786 0.084077 0.765987 O\n0.227504 0.660895 0.186930 O\n0.415446 0.822996 0.028929 O\n0.343277 0.450244 0.415928 O\n0.592857 0.101366 0.831932 O\n0.892359 0.780198 0.149344 O\n0.664991 0.517677 0.423167 O\n0.871093 0.384537 0.570612 O\n",
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"formula_full": "Li12 Ti8 P12 O48",
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{
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"structure_string": "Y1 Er1 Mg2\n1.0\n0.000000 3.788640 3.788640\n3.788640 0.000000 3.788640\n3.788640 3.788640 0.000000\nY Er Mg\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Er\n0.750000 0.750000 0.750000 Mg\n0.250000 0.250000 0.250000 Mg\n",
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{
"id": "mp-2392",
"created_at": "2022-09-04T14:39:27.675028Z",
"structure_string": "Th8 Se20\n1.0\n8.008644 0.000000 0.000000\n0.000000 8.025052 0.000000\n0.000000 0.000000 10.785348\nTh Se\n8 20\ndirect\n0.242423 0.008248 0.852563 Th\n0.257577 0.508248 0.647437 Th\n0.742423 0.991752 0.647437 Th\n0.757577 0.491752 0.852563 Th\n0.757577 0.991752 0.147437 Th\n0.742423 0.491752 0.352563 Th\n0.257577 0.008248 0.352563 Th\n0.242423 0.508248 0.147437 Th\n0.370437 0.379100 0.393392 Se\n0.129563 0.879100 0.106608 Se\n0.870437 0.620900 0.106608 Se\n0.629563 0.120900 0.393392 Se\n0.629563 0.620900 0.606608 Se\n0.870437 0.120900 0.893392 Se\n0.129563 0.379100 0.893392 Se\n0.370437 0.879100 0.606608 Se\n0.886056 0.864787 0.396691 Se\n0.613944 0.364787 0.103309 Se\n0.386056 0.135213 0.103309 Se\n0.113944 0.635213 0.396691 Se\n0.113944 0.135213 0.603309 Se\n0.386056 0.635213 0.896691 Se\n0.613944 0.864787 0.896691 Se\n0.886056 0.364787 0.603309 Se\n0.000000 0.250000 0.247977 Se\n0.500000 0.750000 0.252023 Se\n0.000000 0.750000 0.752023 Se\n0.500000 0.250000 0.747977 Se\n",
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"formula_full": "Th8 Se20",
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{
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"created_at": "2022-09-04T14:39:27.671729Z",
"structure_string": "K3 Pb2 Cl8\n1.0\n8.690223 0.000000 0.000000\n4.226565 7.944577 0.000000\n4.322708 2.572522 7.486148\nK Pb Cl\n3 2 8\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.500000 0.500000 K\n0.500000 0.500000 0.500000 K\n0.500000 0.000000 0.500000 Pb\n0.000000 0.000000 0.500000 Pb\n0.270372 0.232360 0.708704 Cl\n0.729628 0.767640 0.291296 Cl\n0.206767 0.783408 0.294989 Cl\n0.793233 0.216592 0.705011 Cl\n0.763919 0.208190 0.292156 Cl\n0.236081 0.791810 0.707844 Cl\n0.235767 0.200891 0.296816 Cl\n0.764233 0.799109 0.703184 Cl\n",
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{
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"created_at": "2022-09-04T14:39:27.668270Z",
"structure_string": "Cs4 Sr4 O6\n1.0\n7.515486 0.000000 0.000000\n0.000000 7.227120 0.000000\n0.000000 3.290254 6.687132\nCs Sr O\n4 4 6\ndirect\n0.352654 0.822196 0.922930 Cs\n0.147346 0.822196 0.422930 Cs\n0.852654 0.177804 0.577070 Cs\n0.647346 0.177804 0.077070 Cs\n0.620703 0.666744 0.568857 Sr\n0.120703 0.333256 0.931143 Sr\n0.879297 0.666744 0.068857 Sr\n0.379297 0.333256 0.431143 Sr\n0.500000 0.000000 0.500000 O\n0.000000 0.000000 0.000000 O\n0.891269 0.598157 0.770794 O\n0.391269 0.401843 0.729206 O\n0.608731 0.598157 0.270794 O\n0.108731 0.401843 0.229206 O\n",
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{
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{
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"structure_string": "Ca4 H16 Ir4 O8 F24\n1.0\n9.672001 0.000000 0.000000\n0.000000 5.960978 0.000000\n0.000000 4.208425 10.991810\nCa H Ir O F\n4 16 4 8 24\ndirect\n0.680261 0.212670 0.952992 Ca\n0.819739 0.212670 0.452992 Ca\n0.319739 0.787330 0.047008 Ca\n0.180261 0.787330 0.547008 Ca\n0.860506 0.488214 0.075854 H\n0.639494 0.488214 0.575854 H\n0.139494 0.511786 0.924146 H\n0.360506 0.511786 0.424146 H\n0.842107 0.657476 0.939499 H\n0.657893 0.657476 0.439499 H\n0.157893 0.342524 0.060501 H\n0.342107 0.342524 0.560501 H\n0.641957 0.683647 0.063890 H\n0.858043 0.683647 0.563890 H\n0.358043 0.316353 0.936110 H\n0.141957 0.316353 0.436110 H\n0.592181 0.770355 0.169399 H\n0.907819 0.770355 0.669399 H\n0.407819 0.229645 0.830601 H\n0.092181 0.229645 0.330601 H\n0.038832 0.136852 0.766450 Ir\n0.461168 0.136852 0.266450 Ir\n0.961168 0.863148 0.233550 Ir\n0.538832 0.863148 0.733550 Ir\n0.793288 0.537842 0.009158 O\n0.706712 0.537842 0.509158 O\n0.206712 0.462158 0.990842 O\n0.293288 0.462158 0.490842 O\n0.579465 0.798778 0.082046 O\n0.920535 0.798778 0.582046 O\n0.420535 0.201222 0.917954 O\n0.079465 0.201222 0.417954 O\n0.144070 0.446594 0.716114 F\n0.355930 0.446594 0.216114 F\n0.855930 0.553406 0.283886 F\n0.644070 0.553406 0.783886 F\n0.906806 0.275692 0.847438 F\n0.593194 0.275692 0.347438 F\n0.093194 0.724308 0.152562 F\n0.406806 0.724308 0.652562 F\n0.941227 0.821573 0.815362 F\n0.558773 0.821573 0.315362 F\n0.058773 0.178427 0.184638 F\n0.441227 0.178427 0.684638 F\n0.168652 0.003441 0.679518 F\n0.331348 0.003441 0.179518 F\n0.831348 0.996559 0.320482 F\n0.668652 0.996559 0.820482 F\n0.929363 0.263008 0.617587 F\n0.570637 0.263008 0.117587 F\n0.070637 0.736992 0.382413 F\n0.429363 0.736992 0.882413 F\n0.150098 0.015793 0.913762 F\n0.349902 0.015793 0.413762 F\n0.849902 0.984207 0.086238 F\n0.650098 0.984207 0.586238 F\n",
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{
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