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{
"id": "jvasp-116680",
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{
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"structure_string": "Li1 As1 O2\n1.0\n1.563828 0.902876 4.995231\n-1.563828 0.902876 4.995231\n-0.000000 -1.805753 4.995231\nLi As O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 As\n0.250206 0.250206 0.250206 O\n0.749793 0.749793 0.749794 O\n",
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{
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"created_at": "2022-09-04T14:38:44.427182Z",
"updated_at": "2022-09-04T14:38:44.427200Z",
"structure_string": "Li1 P1 S1\n1.0\n4.939004 0.985792 0.000000\n1.060697 4.565849 0.000000\n0.000000 0.000000 3.225369\nLi P S\n1 1 1\ndirect\n-0.104515 -0.078792 0.000000 Li\n0.373462 -0.018677 0.000000 P\n0.003080 0.369496 0.000000 S\n",
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{
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"updated_at": "2022-09-04T14:38:44.423884Z",
"structure_string": "Rb2 Al2 Si6 O16\n1.0\n7.741951 -0.049935 1.952633\n-3.639965 6.833078 1.952633\n0.021079 0.034856 7.200275\nRb Al Si O\n2 2 6 16\ndirect\n0.286071 0.297962 0.855782 Rb\n0.702038 0.713929 0.144216 Rb\n0.596503 0.834180 0.659533 Al\n0.165820 0.403497 0.340465 Al\n0.800305 0.178731 0.224552 Si\n0.196872 0.811883 0.780146 Si\n0.188117 0.803128 0.219853 Si\n0.400199 0.160070 0.341978 Si\n0.839929 0.599801 0.658020 Si\n0.821269 0.199695 0.775447 Si\n0.968451 0.705885 0.405529 O\n0.337795 0.713977 0.748267 O\n0.738212 0.360015 0.733351 O\n0.353089 0.339604 0.279243 O\n0.660396 0.646911 0.720756 O\n0.706808 0.957582 0.391401 O\n0.294115 0.031548 0.594470 O\n0.326459 0.019179 0.215768 O\n0.152168 0.847832 -0.000000 O\n0.842345 0.157654 -0.000000 O\n0.007576 0.333790 0.213792 O\n0.286023 0.662205 0.251732 O\n0.980820 0.673541 0.784231 O\n0.666210 -0.007576 0.786207 O\n0.042418 0.293191 0.608597 O\n0.639985 0.261788 0.266648 O\n",
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{
"id": "jvasp-116778",
"created_at": "2022-09-04T14:38:44.420405Z",
"updated_at": "2022-09-04T14:38:44.420424Z",
"structure_string": "Ho4 Fe4 O12\n1.0\n5.094693 -0.000000 0.000000\n0.000000 5.534375 0.000000\n-0.000000 -0.000000 7.338639\nHo Fe O\n4 4 12\ndirect\n0.023465 0.922804 0.750000 Ho\n0.523465 0.577194 0.250000 Ho\n0.476535 0.422805 0.750000 Ho\n0.976534 0.077195 0.250000 Ho\n-0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.603279 0.030058 0.750000 O\n0.103280 0.469942 0.250000 O\n0.687815 0.303318 0.050878 O\n0.187815 0.196681 0.949122 O\n0.812184 0.803318 0.449122 O\n0.187815 0.196681 0.550878 O\n0.312184 0.696681 0.949122 O\n0.812184 0.803318 0.050878 O\n0.396720 0.969941 0.250000 O\n0.687815 0.303318 0.449122 O\n0.312184 0.696681 0.550878 O\n0.896720 0.530057 0.750000 O\n",
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{
"id": "jvasp-115194",
"created_at": "2022-09-04T14:38:44.416063Z",
"updated_at": "2022-09-04T14:38:44.416084Z",
"structure_string": "Li1 I2\n1.0\n4.429972 0.000000 0.107131\n0.000000 4.378913 0.000000\n-0.144500 0.000000 6.553364\nLi I\n1 2\ndirect\n0.466710 0.000000 0.133352 Li\n-0.032938 0.000000 -0.121201 I\n-0.033771 0.000000 0.387849 I\n",
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"density_atomic": 0.023586209233829102,
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"formula_full": "Li1 I2",
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{
"id": "jvasp-115406",
"created_at": "2022-09-04T14:38:44.415559Z",
"updated_at": "2022-09-04T14:38:44.415586Z",
"structure_string": "As1 N1 F2\n1.0\n3.225501 -0.000000 -0.000000\n0.000000 3.225501 0.000000\n0.000000 0.000000 5.050063\nAs N F\n1 1 2\ndirect\n0.500000 0.500000 0.741019 As\n0.000000 0.000000 0.739214 N\n0.000000 0.000000 0.439121 F\n0.500000 0.500000 0.090645 F\n",
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{
"id": "jvasp-116636",
"created_at": "2022-09-04T14:38:44.415541Z",
"updated_at": "2022-09-04T14:38:44.415567Z",
"structure_string": "Ti9 O10\n1.0\n5.064735 0.023325 0.539945\n-2.674692 4.300942 0.539945\n0.037034 0.067006 10.006371\nTi O\n9 10\ndirect\n0.841469 0.158529 0.500000 Ti\n0.574852 0.895840 0.255301 Ti\n0.351964 0.648035 -0.000000 Ti\n0.104159 0.425147 0.744698 Ti\n0.425146 0.104159 0.744698 Ti\n0.158530 0.841470 0.500000 Ti\n0.895840 0.574852 0.255301 Ti\n0.648035 0.351963 -0.000000 Ti\n0.000000 0.000000 0.000000 Ti\n0.059201 0.712042 0.880688 O\n0.287958 0.940798 0.119311 O\n0.549641 0.191055 0.375568 O\n0.808943 0.450358 0.624431 O\n0.450358 0.808944 0.624431 O\n0.940797 0.287957 0.119311 O\n0.191055 0.549642 0.375568 O\n0.397371 0.397372 0.863865 O\n0.712041 0.059202 0.880688 O\n0.602628 0.602628 0.136134 O\n",
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{
"id": "jvasp-112847",
"created_at": "2022-09-04T14:38:44.411977Z",
"updated_at": "2022-09-04T14:38:44.411996Z",
"structure_string": "Li2 Mn3 Cr1 O8\n1.0\n4.991560 0.018782 2.891052\n1.675364 4.702040 2.891052\n0.026524 0.018782 5.768288\nLi Mn Cr O\n2 3 1 8\ndirect\n0.123792 0.123792 0.123792 Li\n0.876207 0.876208 0.876209 Li\n-0.000001 0.500000 0.500001 Mn\n0.500000 0.500000 -0.000000 Mn\n0.500000 -0.000000 0.500000 Mn\n0.499999 0.500000 0.500000 Cr\n0.262189 0.262189 0.262190 O\n0.714788 0.258465 0.258465 O\n0.258464 0.258465 0.714789 O\n0.258464 0.714788 0.258465 O\n0.741534 0.285211 0.741536 O\n0.741534 0.741535 0.285212 O\n0.737809 0.737810 0.737811 O\n0.285210 0.741535 0.741536 O\n",
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"created_at": "2022-09-04T14:38:44.410287Z",
"updated_at": "2022-09-04T14:38:44.410304Z",
"structure_string": "Li4 Mn4 O2 F12\n1.0\n6.492005 0.066858 -3.301989\n-1.449911 5.277531 1.044425\n0.027071 -0.049616 6.897887\nLi Mn O F\n4 4 2 12\ndirect\n0.792139 0.307459 0.394785 Li\n0.918164 0.791045 0.132255 Li\n0.081837 0.208954 0.867744 Li\n0.207862 0.692540 0.605215 Li\n0.594918 0.222177 0.863373 Mn\n0.281125 0.340668 0.416926 Mn\n0.718876 0.659331 0.583074 Mn\n0.405082 0.777823 0.136627 Mn\n0.499394 0.501208 0.317186 O\n0.500606 0.498791 0.682814 O\n0.905702 0.838549 0.830836 F\n0.187920 0.687924 0.285250 F\n0.665061 0.925709 0.026531 F\n0.919127 0.717255 0.461245 F\n0.080873 0.282744 0.538755 F\n0.393037 0.019336 0.622221 F\n0.812081 0.312075 0.714750 F\n0.094298 0.161451 0.169163 F\n0.759332 0.420637 0.103969 F\n0.240669 0.579363 0.896031 F\n0.334940 0.074290 0.973469 F\n0.606963 0.980663 0.377779 F\n",
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"created_at": "2022-09-04T14:38:44.410263Z",
"updated_at": "2022-09-04T14:38:44.410288Z",
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