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{
"id": "jvasp-109471",
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"structure_string": "Na3 As1 Br6\n1.0\n6.656936 -0.000000 3.843384\n2.218979 6.276220 3.843384\n-0.000000 -0.000000 7.686768\nNa As Br\n3 1 6\ndirect\n0.750001 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 As\n0.756906 0.243094 0.243093 Br\n0.243094 0.243094 0.756906 Br\n0.243094 0.756906 0.756905 Br\n0.243094 0.756906 0.243094 Br\n0.756906 0.243094 0.756905 Br\n0.756906 0.756906 0.243093 Br\n",
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{
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{
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"structure_string": "K2 In2 Cl6\n1.0\n6.656880 -0.000000 3.843351\n2.218960 6.276166 3.843351\n-0.000000 -0.000000 7.686702\nK In Cl\n2 2 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 In\n0.765866 0.234134 0.234133 Cl\n0.234134 0.234134 0.765866 Cl\n0.234134 0.765867 0.765866 Cl\n0.234134 0.765867 0.234133 Cl\n0.765866 0.234134 0.765866 Cl\n0.765866 0.765867 0.234133 Cl\n",
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{
"id": "jvasp-21041",
"created_at": "2022-09-04T14:38:32.056194Z",
"updated_at": "2022-09-04T14:38:32.056234Z",
"structure_string": "Ca4 Mg4 Sn4\n1.0\n4.681713 0.000000 0.000000\n0.000000 7.826301 0.000000\n0.000000 0.000000 8.763488\nCa Mg Sn\n4 4 4\ndirect\n0.749999 0.480103 0.683537 Ca\n0.749999 0.980103 0.816463 Ca\n0.250000 0.519897 0.316463 Ca\n0.250000 0.019897 0.183537 Ca\n0.749999 0.855560 0.436777 Mg\n0.250000 0.144440 0.563223 Mg\n0.250000 0.644439 0.936777 Mg\n0.749999 0.355560 0.063223 Mg\n0.749999 0.735434 0.116059 Sn\n0.250000 0.264565 0.883941 Sn\n0.749999 0.235435 0.383941 Sn\n0.250000 0.764565 0.616059 Sn\n",
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{
"id": "jvasp-55640",
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"updated_at": "2022-09-04T14:36:59.788875Z",
"structure_string": "Bi4 P4 O16\n1.0\n0.000000 6.627068 -0.088282\n6.763853 0.000000 0.000000\n0.000000 -5.103089 -7.095070\nBi P O\n4 4 16\ndirect\n0.702108 0.615602 0.263461 Bi\n0.297892 0.115603 0.236539 Bi\n0.297892 0.384397 0.736539 Bi\n0.702108 0.884397 0.763461 Bi\n0.095144 0.637649 0.221917 P\n0.904856 0.137650 0.278082 P\n0.904856 0.362350 0.778082 P\n0.095144 0.862350 0.721917 P\n0.949024 0.179036 0.904873 O\n0.050976 0.679036 0.595127 O\n0.230182 0.469565 0.195072 O\n0.769818 0.969564 0.304928 O\n0.769818 0.530435 0.804928 O\n0.230182 0.030435 0.695072 O\n0.515127 0.812222 0.438704 O\n0.298643 0.775180 0.934255 O\n0.484873 0.187778 0.561296 O\n0.515127 0.687777 0.938704 O\n0.949024 0.320963 0.404873 O\n0.701357 0.275180 0.565745 O\n0.701357 0.224819 0.065745 O\n0.298643 0.724819 0.434255 O\n0.484873 0.312222 0.061296 O\n0.050976 0.820963 0.095127 O\n",
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{
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"created_at": "2022-09-04T14:38:43.969086Z",
"updated_at": "2022-09-04T14:38:43.969115Z",
"structure_string": "Ca9 Fe2 N8\n1.0\n8.894027 0.013172 3.264701\n1.355060 4.732055 0.000000\n-0.012030 0.003445 7.627374\nCa Fe N\n9 2 8\ndirect\n0.000000 0.499999 0.500000 Ca\n0.074431 0.962782 0.764999 Ca\n0.925570 0.037215 0.235000 Ca\n0.654012 0.672993 0.449121 Ca\n0.345989 0.327005 0.550878 Ca\n0.822526 0.588736 0.982794 Ca\n0.177475 0.411262 0.017205 Ca\n0.611811 0.194093 0.812565 Ca\n0.388190 0.805904 0.187434 Ca\n0.614178 0.192911 0.200934 Fe\n0.385823 0.807087 0.799065 Fe\n0.216853 0.891573 0.000699 N\n0.783148 0.108426 -0.000699 N\n0.362847 0.818575 0.583295 N\n0.637153 0.181423 0.416705 N\n0.572172 0.713913 0.812997 N\n0.427829 0.286084 0.187002 N\n0.074922 0.462538 0.755355 N\n0.925079 0.537460 0.244644 N\n",
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{
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"created_at": "2022-09-04T14:36:39.265731Z",
"updated_at": "2022-09-04T14:36:39.265748Z",
"structure_string": "Rb2 La1 Ag1 Cl6\n1.0\n6.656393 -0.000000 3.843070\n2.218798 6.275707 3.843070\n-0.000000 -0.000000 7.686140\nRb La Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Ag\n0.747099 0.252900 0.252900 Cl\n0.252900 0.252900 0.747100 Cl\n0.252900 0.747100 0.747099 Cl\n0.252900 0.747100 0.252900 Cl\n0.747099 0.252900 0.747100 Cl\n0.747100 0.747100 0.252900 Cl\n",
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{
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"created_at": "2022-09-04T14:38:06.154650Z",
"updated_at": "2022-09-04T14:38:06.154659Z",
"structure_string": "Ca4 Sn2 S8\n1.0\n3.972317 0.000000 0.000000\n0.000000 7.093421 -0.000000\n0.000000 -0.000000 11.394775\nCa Sn S\n4 2 8\ndirect\n0.500000 0.405861 0.815573 Ca\n0.500000 0.594138 0.184427 Ca\n0.500000 0.905861 0.684427 Ca\n0.500000 0.094139 0.315573 Ca\n0.000000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.500000 0.261715 0.551640 S\n0.500000 0.738285 0.448360 S\n0.500000 0.761714 0.948360 S\n0.500000 0.238285 0.051640 S\n0.000000 0.126020 0.794197 S\n0.000000 0.873980 0.205803 S\n0.000000 0.626019 0.705804 S\n0.000000 0.373980 0.294197 S\n",
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"structure_string": "Bi4 P4 O16\n1.0\n0.000000 6.627001 -0.088402\n6.763876 0.000000 0.000000\n0.000000 -5.102907 -7.094867\nBi P O\n4 4 16\ndirect\n0.702105 0.615600 0.263461 Bi\n0.297895 0.115599 0.236539 Bi\n0.297894 0.384401 0.736539 Bi\n0.702105 0.884401 0.763462 Bi\n0.095152 0.637647 0.221916 P\n0.904847 0.137647 0.278084 P\n0.904847 0.362353 0.778084 P\n0.095152 0.862354 0.721916 P\n0.949014 0.179039 0.904879 O\n0.050985 0.679039 0.595121 O\n0.230185 0.469557 0.195072 O\n0.769815 0.969557 0.304928 O\n0.769815 0.530444 0.804928 O\n0.230185 0.030443 0.695072 O\n0.515130 0.812226 0.438695 O\n0.298659 0.775185 0.934260 O\n0.484869 0.187774 0.561305 O\n0.515130 0.687775 0.938695 O\n0.949014 0.320961 0.404879 O\n0.701340 0.275184 0.565741 O\n0.701340 0.224816 0.065740 O\n0.298659 0.724816 0.434260 O\n0.484869 0.312226 0.061305 O\n0.050985 0.820962 0.095121 O\n",
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{
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"created_at": "2022-09-04T14:36:00.613556Z",
"updated_at": "2022-09-04T14:36:00.613583Z",
"structure_string": "La6 F18\n1.0\n7.194447 0.000000 0.000000\n-3.597223 6.230574 0.000000\n-0.000000 0.000000 7.162527\nLa F\n6 18\ndirect\n0.326304 0.326304 0.000000 La\n0.326304 0.000000 0.500000 La\n0.673696 0.000000 0.000000 La\n0.000000 0.673695 0.000000 La\n0.673696 0.673695 0.500000 La\n0.000000 0.326304 0.500000 La\n0.343602 0.343606 0.334043 F\n0.656394 -0.000005 0.334043 F\n0.000005 0.656398 0.334043 F\n-0.000005 0.343601 0.834043 F\n0.656399 0.000005 0.665958 F\n0.656399 0.656393 0.834043 F\n0.000000 0.000000 0.750000 F\n0.000005 0.343606 0.165958 F\n-0.000005 0.656393 0.665958 F\n0.343606 0.343601 0.665958 F\n0.343601 -0.000005 0.165958 F\n0.333334 0.666666 -0.000008 F\n0.666667 0.333333 0.499993 F\n0.666667 0.333333 0.000008 F\n0.333334 0.666666 0.500008 F\n0.000000 0.000000 0.250000 F\n0.656394 0.656398 0.165958 F\n0.343606 0.000005 0.834043 F\n",
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{
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"structure_string": "Zn8 S8\n1.0\n1.919411 -3.324518 0.000000\n1.919411 3.324518 -0.000000\n-0.000000 -0.000000 25.156879\nZn S\n8 8\ndirect\n0.666667 0.333333 0.125092 Zn\n0.000000 0.000000 0.000372 Zn\n0.333333 0.666667 0.624835 Zn\n0.333333 0.666667 0.875338 Zn\n0.000000 0.000000 0.750101 Zn\n0.666667 0.333333 0.375141 Zn\n0.000000 0.000000 0.499857 Zn\n0.333333 0.666667 0.250075 Zn\n0.333333 0.666667 0.343791 S\n0.333333 0.666667 0.969024 S\n0.666667 0.333333 0.218606 S\n0.000000 0.000000 0.593371 S\n0.000000 0.000000 0.093859 S\n0.000000 0.000000 0.843774 S\n0.666667 0.333333 0.468624 S\n0.333333 0.666667 0.718540 S\n",
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{
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"structure_string": "Li4 Mn4 F20\n1.0\n9.770600 -0.000000 0.000000\n-0.000000 4.242726 1.476599\n0.000000 -1.499724 7.222926\nLi Mn F\n4 4 20\ndirect\n0.283334 0.063490 0.842922 Li\n0.216666 0.063489 0.342922 Li\n0.783334 0.936513 0.657078 Li\n0.716666 0.936512 0.157078 Li\n0.573177 0.524611 0.820330 Mn\n0.073177 0.475392 0.679670 Mn\n0.926823 0.524610 0.320330 Mn\n0.426823 0.475391 0.179670 Mn\n0.199105 0.243327 0.579284 F\n0.206115 0.690616 0.762628 F\n0.558938 0.700699 0.258153 F\n0.699105 0.756675 0.920716 F\n0.565329 0.268634 0.054334 F\n0.058938 0.299303 0.241847 F\n0.571386 0.792361 0.624801 F\n0.065329 0.731368 0.445666 F\n0.428614 0.207641 0.375199 F\n0.934671 0.268634 0.554334 F\n0.793885 0.309386 0.237372 F\n0.441062 0.299303 0.741848 F\n0.928614 0.792360 0.124801 F\n0.434671 0.731368 0.945667 F\n0.941062 0.700699 0.758153 F\n0.300895 0.243326 0.079284 F\n0.071386 0.207641 0.875199 F\n0.706115 0.309386 0.737372 F\n0.800895 0.756675 0.420716 F\n0.293885 0.690616 0.262628 F\n",
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]
}