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{
"id": "mp-583221",
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{
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{
"id": "mp-1214303",
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"structure_string": "Ca8 As4 H16 F52\n1.0\n7.318162 0.000000 0.000000\n0.000000 7.318162 0.000000\n0.000000 0.000000 17.750928\nCa As H F\n8 4 16 52\ndirect\n0.243040 0.221361 0.035098 Ca\n0.756960 0.778639 0.535098 Ca\n0.778639 0.243040 0.285098 Ca\n0.756960 0.221361 0.964902 Ca\n0.221361 0.756960 0.785098 Ca\n0.243040 0.778639 0.464902 Ca\n0.221361 0.243040 0.714902 Ca\n0.778639 0.756960 0.214902 Ca\n0.500000 0.716834 0.000000 As\n0.500000 0.283166 0.500000 As\n0.283166 0.500000 0.250000 As\n0.716834 0.500000 0.750000 As\n0.116346 0.034538 0.189321 H\n0.883654 0.965462 0.689321 H\n0.965462 0.116346 0.439321 H\n0.883654 0.034538 0.810679 H\n0.034538 0.883654 0.939321 H\n0.116346 0.965462 0.310679 H\n0.034538 0.116346 0.560679 H\n0.965462 0.883654 0.060679 H\n0.612776 0.128390 0.127676 H\n0.387224 0.871610 0.627676 H\n0.871610 0.612776 0.377676 H\n0.387224 0.128390 0.872324 H\n0.128390 0.387224 0.877676 H\n0.612776 0.871610 0.372324 H\n0.128390 0.612776 0.622324 H\n0.871610 0.387224 0.122324 H\n0.113313 0.332967 0.266808 F\n0.886687 0.667033 0.766808 F\n0.667033 0.113313 0.516808 F\n0.886687 0.332967 0.733192 F\n0.332967 0.886687 0.016808 F\n0.113313 0.667033 0.233192 F\n0.332967 0.113313 0.483192 F\n0.667033 0.886687 0.983192 F\n0.000000 0.006066 0.000000 F\n0.000000 0.993934 0.500000 F\n0.993934 0.000000 0.250000 F\n0.006066 0.000000 0.750000 F\n0.671782 0.063748 0.179923 F\n0.328218 0.936252 0.679923 F\n0.936252 0.671782 0.429923 F\n0.328218 0.063748 0.820077 F\n0.063748 0.328218 0.929923 F\n0.671782 0.936252 0.320077 F\n0.063748 0.671782 0.570077 F\n0.936252 0.328218 0.070077 F\n0.557951 0.196832 0.071526 F\n0.442049 0.803168 0.571526 F\n0.803168 0.557951 0.321526 F\n0.442049 0.196832 0.928474 F\n0.196832 0.442049 0.821526 F\n0.557951 0.803168 0.428474 F\n0.196832 0.557951 0.678474 F\n0.803168 0.442049 0.178474 F\n0.456071 0.332622 0.264269 F\n0.543929 0.667378 0.764269 F\n0.667378 0.456071 0.514269 F\n0.543929 0.332622 0.735731 F\n0.332622 0.543929 0.014269 F\n0.456071 0.667378 0.235731 F\n0.332622 0.456071 0.485731 F\n0.667378 0.543929 0.985731 F\n0.281897 0.445276 0.153212 F\n0.718103 0.554724 0.653212 F\n0.554724 0.281897 0.403212 F\n0.718103 0.445276 0.846788 F\n0.445276 0.718103 0.903212 F\n0.281897 0.554724 0.346788 F\n0.445276 0.281897 0.596788 F\n0.554724 0.718103 0.096788 F\n0.204816 0.062126 0.148105 F\n0.795184 0.937874 0.648105 F\n0.937874 0.204816 0.398105 F\n0.795184 0.062126 0.851895 F\n0.062126 0.795184 0.898105 F\n0.204816 0.937874 0.351895 F\n0.062126 0.204816 0.601895 F\n0.937874 0.795184 0.101895 F\n",
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{
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{
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"structure_string": "Li2 Ti2 Si2 O8\n1.0\n-2.839656 2.900527 4.037600\n2.839656 -2.900527 4.037600\n2.839656 2.900527 -4.037600\nLi Ti Si O\n2 2 2 8\ndirect\n0.500000 0.500000 0.000000 Li\n0.000000 0.500000 0.500000 Li\n0.000000 0.500000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.633815 0.883815 0.750000 Si\n0.366185 0.116185 0.250000 Si\n0.246557 0.233191 0.486635 O\n0.246557 0.759922 0.013365 O\n0.721984 0.237661 0.484323 O\n0.253339 0.237661 0.015677 O\n0.278016 0.762339 0.515677 O\n0.746661 0.762339 0.984323 O\n0.753443 0.240078 0.986635 O\n0.753443 0.766809 0.513365 O\n",
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{
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