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{
"id": "mp-767692",
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{
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{
"id": "mp-1175314",
"created_at": "2022-09-04T14:42:54.038750Z",
"structure_string": "Li7 Mn5 O12\n1.0\n4.535868 0.076507 2.207468\n-2.177072 9.685750 -0.304297\n0.144019 -0.074779 5.042078\nLi Mn O\n7 5 12\ndirect\n0.333354 0.000005 0.333338 Li\n0.746895 0.242442 0.001200 Li\n0.919781 0.757561 0.665461 Li\n0.579733 0.752413 0.331533 Li\n0.086923 0.247596 0.335144 Li\n0.413452 0.247643 0.662153 Li\n0.253225 0.752364 0.004496 Li\n0.500358 0.498827 0.999347 Mn\n0.166297 0.501191 0.667334 Mn\n0.833281 0.499978 0.333384 Mn\n0.001310 0.000010 0.001260 Mn\n0.665371 0.999986 0.665402 Mn\n0.015903 0.111948 0.687894 O\n0.650774 0.888048 0.978765 O\n0.844580 0.617378 0.027808 O\n0.822096 0.382625 0.638861 O\n0.740564 0.108928 0.318972 O\n0.926151 0.891077 0.347656 O\n0.384183 0.108978 0.962076 O\n0.282492 0.891014 0.704598 O\n0.180143 0.620741 0.360777 O\n0.486502 0.379254 0.305882 O\n0.512571 0.618199 0.693552 O\n0.154059 0.381793 0.973108 O\n",
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{
"id": "mp-1218099",
"created_at": "2022-09-04T14:42:54.055854Z",
"structure_string": "Ta6 Ti1 Tl2 O18\n1.0\n3.815103 6.594212 0.000000\n-3.815103 6.594212 0.000000\n0.000000 0.026050 8.347745\nTa Ti Tl O\n6 1 2 18\ndirect\n0.663765 0.171534 0.848663 Ta\n0.167059 0.666014 0.848375 Ta\n0.164424 0.171128 0.848591 Ta\n0.333986 0.832941 0.151625 Ta\n0.828466 0.336235 0.151337 Ta\n0.828872 0.835576 0.151409 Ta\n0.999330 0.000670 0.500000 Ti\n0.277103 0.361698 0.307182 Tl\n0.638302 0.722897 0.692818 Tl\n0.101810 0.449961 0.840649 O\n0.449112 0.101613 0.839191 O\n0.448480 0.450408 0.840405 O\n0.898387 0.550888 0.160809 O\n0.550039 0.898190 0.159351 O\n0.549592 0.551520 0.159595 O\n0.283650 0.858955 0.898835 O\n0.858437 0.283396 0.899371 O\n0.857278 0.858497 0.899133 O\n0.716604 0.141563 0.100629 O\n0.141045 0.716350 0.101165 O\n0.141503 0.142722 0.100867 O\n0.758534 0.119390 0.638992 O\n0.120978 0.757888 0.637953 O\n0.122556 0.120034 0.638329 O\n0.242112 0.879022 0.362047 O\n0.880610 0.241466 0.361008 O\n0.879966 0.877444 0.361671 O\n",
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"formula_full": "Ta6 Ti1 Tl2 O18",
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"spacegroup": 5
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{
"id": "mp-1193215",
"created_at": "2022-09-04T14:42:54.076650Z",
"structure_string": "Li4 I4 O20\n1.0\n5.080593 0.000000 0.000000\n0.000000 5.491146 0.000000\n0.000000 5.455269 14.615407\nLi I O\n4 4 20\ndirect\n0.534625 0.716810 0.278414 Li\n0.965375 0.716810 0.778414 Li\n0.465375 0.283190 0.721586 Li\n0.034625 0.283190 0.221586 Li\n0.529611 0.106917 0.393750 I\n0.970389 0.106917 0.893750 I\n0.470389 0.893083 0.606250 I\n0.029611 0.893083 0.106250 I\n0.704566 0.866750 0.506110 O\n0.795434 0.866750 0.006110 O\n0.295434 0.133250 0.493890 O\n0.204566 0.133250 0.993890 O\n0.332469 0.838513 0.378065 O\n0.167531 0.838513 0.878065 O\n0.667531 0.161487 0.621935 O\n0.832469 0.161487 0.121935 O\n0.324406 0.347260 0.306957 O\n0.175594 0.347260 0.806957 O\n0.675594 0.652740 0.693043 O\n0.824406 0.652740 0.193043 O\n0.734699 0.390292 0.392190 O\n0.765301 0.390292 0.892190 O\n0.265301 0.609708 0.607810 O\n0.234699 0.609708 0.107810 O\n0.778577 0.031374 0.319644 O\n0.721423 0.031374 0.819644 O\n0.221423 0.968626 0.680356 O\n0.278577 0.968626 0.180356 O\n",
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{
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"structure_string": "Tm2 Ni12 As7\n1.0\n4.676173 -8.099370 0.000000\n4.676173 8.099370 0.000000\n0.000000 0.000000 3.804677\nTm Ni As\n2 12 7\ndirect\n0.000000 0.000000 0.000000 Tm\n0.333333 0.666667 0.500000 Tm\n0.818667 0.613913 0.000000 Ni\n0.386087 0.204755 0.000000 Ni\n0.795245 0.181333 0.000000 Ni\n0.044698 0.759038 0.500000 Ni\n0.240962 0.285660 0.500000 Ni\n0.714340 0.955302 0.500000 Ni\n0.107428 0.389782 0.000000 Ni\n0.610218 0.717646 0.000000 Ni\n0.282354 0.892572 0.000000 Ni\n0.879455 0.428898 0.500000 Ni\n0.571102 0.450557 0.500000 Ni\n0.549443 0.120545 0.500000 Ni\n0.666667 0.333333 0.000000 As\n0.778868 0.743410 0.500000 As\n0.256590 0.035458 0.500000 As\n0.964542 0.221132 0.500000 As\n0.070761 0.617094 0.000000 As\n0.382906 0.453667 0.000000 As\n0.546333 0.929239 0.000000 As\n",
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{
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"structure_string": "Sr4 S3 O1\n1.0\n5.903000 0.000000 0.000000\n0.000000 5.903000 0.000000\n0.000000 0.000000 5.903000\nSr S O\n4 3 1\ndirect\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.000000 Sr\n0.500000 0.500000 0.000000 S\n0.500000 0.000000 0.500000 S\n0.000000 0.500000 0.500000 S\n0.000000 0.000000 0.000000 O\n",
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{
"id": "mp-560173",
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"structure_string": "K12 Al12 Si12 O48\n1.0\n9.175738 0.000000 0.000000\n0.000000 8.685638 0.000000\n0.000000 0.058591 15.908058\nK Al Si O\n12 12 12 48\ndirect\n0.999955 0.245556 0.938536 K\n0.003551 0.747778 0.548387 K\n0.983201 0.746271 0.891886 K\n0.969506 0.751994 0.293681 K\n0.469506 0.248006 0.706319 K\n0.012987 0.247693 0.604514 K\n0.503551 0.252222 0.451613 K\n0.530502 0.746856 0.792039 K\n0.512987 0.752307 0.395486 K\n0.499955 0.754444 0.061464 K\n0.030502 0.253144 0.207961 K\n0.483201 0.253729 0.108114 K\n0.342499 0.562712 0.563325 Al\n0.334348 0.435079 0.887309 Al\n0.164889 0.938584 0.055210 Al\n0.834348 0.564921 0.112691 Al\n0.657151 0.065358 0.274587 Al\n0.664889 0.061416 0.944790 Al\n0.842499 0.437288 0.436675 Al\n0.823430 0.433221 0.768695 Al\n0.674363 0.932920 0.600390 Al\n0.174363 0.067080 0.399610 Al\n0.157151 0.934642 0.725413 Al\n0.323430 0.566779 0.231305 Al\n0.822882 0.056531 0.769425 Si\n0.175006 0.443624 0.400372 Si\n0.333500 0.053366 0.887086 Si\n0.167193 0.552472 0.055473 Si\n0.842385 0.056218 0.436072 Si\n0.833500 0.946634 0.112914 Si\n0.342385 0.943782 0.563928 Si\n0.322882 0.943469 0.230575 Si\n0.155751 0.554835 0.725500 Si\n0.655751 0.445165 0.274500 Si\n0.667193 0.447528 0.944527 Si\n0.675006 0.556376 0.599628 Si\n0.779094 0.237812 0.756330 O\n0.996602 0.033764 0.751092 O\n0.706982 0.976583 0.042317 O\n0.514550 0.476616 0.581197 O\n0.168064 0.738546 0.039440 O\n0.705466 0.533644 0.033104 O\n0.175595 0.262149 0.427301 O\n0.502112 0.022143 0.584477 O\n0.300311 0.529192 0.456911 O\n0.668064 0.261454 0.960560 O\n0.288889 0.504440 0.126954 O\n0.288199 0.531223 0.793385 O\n0.343442 0.237394 0.865999 O\n0.805818 0.019127 0.534859 O\n0.792397 0.003264 0.867749 O\n0.610758 0.262365 0.280004 O\n0.800311 0.470808 0.543089 O\n0.292397 0.996736 0.132251 O\n0.788889 0.495560 0.873046 O\n0.216300 0.012631 0.627291 O\n0.849891 0.240291 0.421604 O\n0.205466 0.466356 0.966896 O\n0.208822 0.489653 0.632869 O\n0.796116 0.038971 0.199960 O\n0.675595 0.737851 0.572699 O\n0.496602 0.966236 0.248908 O\n0.349891 0.759709 0.578396 O\n0.788199 0.468777 0.206615 O\n0.002112 0.977857 0.415523 O\n0.505783 0.509969 0.916240 O\n0.014550 0.523384 0.418803 O\n0.219994 0.046187 0.292869 O\n0.511230 0.543357 0.247150 O\n0.843442 0.762606 0.134001 O\n0.206982 0.023417 0.957683 O\n0.491022 0.987669 0.920928 O\n0.210264 0.462981 0.300025 O\n0.710264 0.537019 0.699975 O\n0.279094 0.762188 0.243670 O\n0.719994 0.953813 0.707131 O\n0.708822 0.510347 0.367131 O\n0.716300 0.987369 0.372709 O\n0.110758 0.737635 0.719996 O\n0.991022 0.012331 0.079072 O\n0.011230 0.456643 0.752850 O\n0.296116 0.961029 0.800040 O\n0.305818 0.980873 0.465141 O\n0.005783 0.490031 0.083760 O\n",
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{
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{
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"structure_string": "Li8 Ni5 O10\n1.0\n3.042405 -5.310059 -5.083775\n4.593108 2.676404 -0.004687\n3.046810 0.017842 5.066848\nLi Ni O\n8 5 10\ndirect\n0.699600 0.024450 0.312799 Li\n0.130212 0.587667 0.486623 Li\n0.269599 0.212546 0.913185 Li\n0.059902 0.845061 0.672532 Li\n0.700636 0.775497 0.087131 Li\n0.522521 0.406902 0.906891 Li\n0.877599 0.392904 0.493233 Li\n0.340110 0.954927 0.727631 Li\n0.992895 0.004342 0.008683 Ni\n0.199968 0.399977 0.200018 Ni\n0.595446 0.207820 0.588844 Ni\n0.407053 0.795596 0.391292 Ni\n0.804473 0.592146 0.811152 Ni\n0.453310 0.215574 0.220716 O\n0.232710 0.831500 0.015732 O\n0.044952 0.433142 0.806097 O\n0.354959 0.367069 0.593778 O\n0.844827 0.015373 0.641721 O\n0.167473 0.968474 0.384424 O\n0.651981 0.625307 0.426229 O\n0.946723 0.584103 0.179464 O\n0.747750 0.174621 0.973547 O\n0.555136 0.784665 0.758112 O\n",
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}