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{
"id": "mp-27562",
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{
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{
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{
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"structure_string": "Li8 H32 S8 N8 O40\n1.0\n6.814324 0.000000 0.000000\n0.000000 7.491966 0.000000\n0.000000 0.000000 18.428555\nLi H S N O\n8 32 8 8 40\ndirect\n0.912166 0.747540 0.762314 Li\n0.087834 0.752460 0.262314 Li\n0.587834 0.247540 0.237686 Li\n0.412166 0.252460 0.737686 Li\n0.087834 0.252460 0.237686 Li\n0.912166 0.247540 0.737686 Li\n0.412166 0.752460 0.762314 Li\n0.587834 0.747540 0.262314 Li\n0.825354 0.975733 0.903933 H\n0.174646 0.524267 0.403933 H\n0.674646 0.475733 0.096067 H\n0.325354 0.024267 0.596067 H\n0.174646 0.024267 0.096067 H\n0.825354 0.475733 0.596067 H\n0.325354 0.524267 0.903933 H\n0.674646 0.975733 0.403933 H\n0.658579 0.129514 0.933594 H\n0.341421 0.370486 0.433594 H\n0.841421 0.629514 0.066406 H\n0.158579 0.870486 0.566406 H\n0.341421 0.870486 0.066406 H\n0.658579 0.629514 0.566406 H\n0.158579 0.370486 0.933594 H\n0.841421 0.129514 0.433594 H\n0.772869 0.994898 0.995202 H\n0.227131 0.505102 0.495202 H\n0.727131 0.494898 0.004798 H\n0.272869 0.005102 0.504798 H\n0.227131 0.005102 0.004798 H\n0.772869 0.494898 0.504798 H\n0.272869 0.505102 0.995202 H\n0.727131 0.994898 0.495202 H\n0.481136 0.896401 0.898361 H\n0.518864 0.603599 0.398361 H\n0.018864 0.396401 0.101639 H\n0.981136 0.103599 0.601639 H\n0.518864 0.103599 0.101639 H\n0.481136 0.396401 0.601639 H\n0.981136 0.603599 0.898361 H\n0.018864 0.896401 0.398361 H\n0.658320 0.949768 0.655632 S\n0.341680 0.550232 0.155632 S\n0.841680 0.449768 0.344368 S\n0.158320 0.050232 0.844368 S\n0.341680 0.050232 0.344368 S\n0.658320 0.449768 0.844368 S\n0.158320 0.550232 0.655632 S\n0.841680 0.949768 0.155632 S\n0.715685 0.002092 0.942861 N\n0.284315 0.497908 0.442861 N\n0.784315 0.502092 0.057139 N\n0.215685 0.997908 0.557139 N\n0.284315 0.997908 0.057139 N\n0.715685 0.502092 0.557139 N\n0.215685 0.497908 0.942861 N\n0.784315 0.002092 0.442861 N\n0.838729 0.561101 0.834538 O\n0.161271 0.938899 0.334538 O\n0.661271 0.061101 0.165462 O\n0.338729 0.438899 0.665462 O\n0.161271 0.438899 0.165462 O\n0.838729 0.061101 0.665462 O\n0.338729 0.938899 0.834538 O\n0.661271 0.561101 0.334538 O\n0.979214 0.941530 0.830530 O\n0.020786 0.558470 0.330530 O\n0.520786 0.441530 0.169470 O\n0.479214 0.058470 0.669470 O\n0.020786 0.058470 0.169470 O\n0.979214 0.441530 0.669470 O\n0.479214 0.558470 0.830530 O\n0.520786 0.941530 0.330530 O\n0.664787 0.800003 0.709277 O\n0.335213 0.699997 0.209277 O\n0.835213 0.300003 0.290723 O\n0.164787 0.199997 0.790723 O\n0.335213 0.199997 0.290723 O\n0.664787 0.300003 0.790723 O\n0.164787 0.699997 0.709277 O\n0.835213 0.800003 0.209277 O\n0.650571 0.877914 0.580366 O\n0.349429 0.622086 0.080366 O\n0.849429 0.377914 0.419634 O\n0.150571 0.122086 0.919634 O\n0.349429 0.122086 0.419634 O\n0.650571 0.377914 0.919634 O\n0.150571 0.622086 0.580366 O\n0.849429 0.877914 0.080366 O\n0.571401 0.865724 0.940628 O\n0.428599 0.634276 0.440628 O\n0.928599 0.365724 0.059372 O\n0.071401 0.134276 0.559372 O\n0.428599 0.134276 0.059372 O\n0.571401 0.365724 0.559372 O\n0.071401 0.634276 0.940628 O\n0.928599 0.865724 0.440628 O\n",
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{
"id": "mp-1388111",
"created_at": "2022-09-04T14:40:43.263774Z",
"structure_string": "Ca2 Fe4 S8\n1.0\n0.000000 5.113413 5.113413\n5.113413 0.000000 5.113413\n5.113413 5.113413 0.000000\nCa Fe S\n2 4 8\ndirect\n0.500000 0.500000 0.500000 Ca\n0.750000 0.750000 0.750000 Ca\n0.125000 0.125000 0.125000 Fe\n0.625000 0.125000 0.125000 Fe\n0.125000 0.625000 0.125000 Fe\n0.125000 0.125000 0.625000 Fe\n0.352101 0.352101 0.352101 S\n0.306302 0.897899 0.897899 S\n0.897899 0.897899 0.306302 S\n0.897899 0.306302 0.897899 S\n0.352101 0.352101 0.943698 S\n0.352101 0.943698 0.352101 S\n0.897899 0.897899 0.897899 S\n0.943698 0.352101 0.352101 S\n",
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{
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"structure_string": "K2 Al2 Si6 O16\n1.0\n7.221903 0.000000 0.000000\n-1.917686 7.708483 0.000000\n-2.031430 -3.730105 6.774704\nK Al Si O\n2 2 6 16\ndirect\n0.864190 0.712117 0.708578 K\n0.135810 0.287883 0.291422 K\n0.657931 0.167031 0.405762 Al\n0.342069 0.832969 0.594238 Al\n0.662407 0.404280 0.166536 Si\n0.337593 0.595720 0.833464 Si\n0.776596 0.802182 0.178529 Si\n0.780675 0.187598 0.807842 Si\n0.223404 0.197818 0.821471 Si\n0.219325 0.812402 0.192158 Si\n0.988358 0.826620 0.134212 O\n0.011642 0.173380 0.865788 O\n0.588938 0.703083 0.959658 O\n0.611455 0.965237 0.712498 O\n0.411062 0.296917 0.040342 O\n0.388545 0.034763 0.287502 O\n0.794583 0.017061 0.326809 O\n0.786887 0.332463 0.025488 O\n0.205417 0.982939 0.673191 O\n0.213113 0.667537 0.974512 O\n0.736104 0.646491 0.265512 O\n0.746176 0.285667 0.664685 O\n0.263896 0.353509 0.734488 O\n0.253824 0.714333 0.335315 O\n0.724029 0.361268 0.349889 O\n0.275971 0.638732 0.650111 O\n",
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{
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"structure_string": "K2 Na4 Li6 Fe4 Si24 O60\n1.0\n5.097384 -8.828928 0.000000\n5.097384 8.828928 0.000000\n0.000000 0.000000 14.302642\nK Na Li Fe Si O\n2 4 6 4 24 60\ndirect\n0.000000 0.000000 0.250000 K\n0.000000 0.000000 0.750000 K\n0.666667 0.333333 0.500000 Na\n0.666667 0.333333 0.000000 Na\n0.333333 0.666667 0.000000 Na\n0.333333 0.666667 0.500000 Na\n0.500000 0.000000 0.250000 Li\n0.000000 0.500000 0.750000 Li\n0.500000 0.500000 0.750000 Li\n0.500000 0.000000 0.750000 Li\n0.000000 0.500000 0.250000 Li\n0.500000 0.500000 0.250000 Li\n0.333333 0.666667 0.750000 Fe\n0.666667 0.333333 0.750000 Fe\n0.666667 0.333333 0.250000 Fe\n0.333333 0.666667 0.250000 Fe\n0.355255 0.119577 0.387912 Si\n0.764323 0.644745 0.612088 Si\n0.355255 0.119577 0.612088 Si\n0.644745 0.764323 0.887912 Si\n0.119577 0.355255 0.887912 Si\n0.880423 0.644745 0.887912 Si\n0.355255 0.235677 0.887912 Si\n0.235677 0.880423 0.887912 Si\n0.764323 0.644745 0.387912 Si\n0.764323 0.119577 0.887912 Si\n0.880423 0.235677 0.387912 Si\n0.119577 0.764323 0.387912 Si\n0.235677 0.880423 0.112088 Si\n0.880423 0.235677 0.612088 Si\n0.644745 0.880423 0.387912 Si\n0.355255 0.235677 0.112088 Si\n0.880423 0.644745 0.112088 Si\n0.119577 0.355255 0.112088 Si\n0.644745 0.764323 0.112088 Si\n0.764323 0.119577 0.112088 Si\n0.119577 0.764323 0.612088 Si\n0.644745 0.880423 0.612088 Si\n0.235677 0.355255 0.612088 Si\n0.235677 0.355255 0.387912 Si\n0.139585 0.739547 0.500000 O\n0.494111 0.658329 0.829740 O\n0.164218 0.505889 0.829740 O\n0.835782 0.494111 0.829740 O\n0.341671 0.505889 0.670260 O\n0.658329 0.494111 0.670260 O\n0.658329 0.164218 0.829740 O\n0.835782 0.341671 0.670260 O\n0.164218 0.658329 0.670260 O\n0.494111 0.835782 0.670260 O\n0.505889 0.341671 0.829740 O\n0.341671 0.835782 0.829740 O\n0.658329 0.494111 0.329740 O\n0.505889 0.164218 0.329740 O\n0.835782 0.341671 0.329740 O\n0.164218 0.658329 0.329740 O\n0.341671 0.835782 0.170260 O\n0.341671 0.505889 0.329740 O\n0.494111 0.835782 0.329740 O\n0.505889 0.341671 0.170260 O\n0.835782 0.494111 0.170260 O\n0.164218 0.505889 0.170260 O\n0.494111 0.658329 0.170260 O\n0.658329 0.164218 0.170260 O\n0.275518 0.054086 0.864825 O\n0.724482 0.778568 0.635175 O\n0.221432 0.945914 0.635175 O\n0.778568 0.054086 0.635175 O\n0.945914 0.221432 0.864825 O\n0.945914 0.724482 0.635175 O\n0.275518 0.221432 0.635175 O\n0.724482 0.945914 0.864825 O\n0.221432 0.275518 0.864825 O\n0.778568 0.724482 0.864825 O\n0.739547 0.139585 0.000000 O\n0.599963 0.739547 0.000000 O\n0.139585 0.400037 0.000000 O\n0.860415 0.599963 0.000000 O\n0.400037 0.260453 0.000000 O\n0.599963 0.860415 0.500000 O\n0.260453 0.400037 0.500000 O\n0.260453 0.860415 0.000000 O\n0.505889 0.164218 0.670260 O\n0.860415 0.260453 0.500000 O\n0.400037 0.139585 0.500000 O\n0.739547 0.599963 0.500000 O\n0.945914 0.221432 0.135175 O\n0.724482 0.945914 0.135175 O\n0.221432 0.275518 0.135175 O\n0.778568 0.724482 0.135175 O\n0.275518 0.054086 0.135175 O\n0.724482 0.778568 0.364825 O\n0.054086 0.275518 0.364825 O\n0.054086 0.778568 0.135175 O\n0.221432 0.945914 0.364825 O\n0.778568 0.054086 0.364825 O\n0.275518 0.221432 0.364825 O\n0.945914 0.724482 0.364825 O\n0.054086 0.778568 0.864825 O\n0.054086 0.275518 0.635175 O\n",
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