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{
"id": "mp-1229181",
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{
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"structure_string": "Ag10 Te2 P2 O8\n1.0\n7.144885 0.000000 0.000000\n0.000000 7.144885 0.000000\n0.000000 0.000000 7.399665\nAg Te P O\n10 2 2 8\ndirect\n0.772409 0.727591 0.200320 Ag\n0.227591 0.727591 0.200320 Ag\n0.772409 0.272409 0.200320 Ag\n0.227591 0.272409 0.200320 Ag\n0.727591 0.772409 0.799680 Ag\n0.272409 0.772409 0.799680 Ag\n0.727591 0.227591 0.799680 Ag\n0.272409 0.227591 0.799680 Ag\n0.000000 0.500000 0.461760 Ag\n0.500000 0.000000 0.538240 Ag\n0.000000 0.500000 0.005451 Te\n0.500000 0.000000 0.994549 Te\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.500000 P\n0.500000 0.319593 0.380535 O\n0.500000 0.680407 0.380535 O\n0.819593 0.000000 0.380535 O\n0.180407 0.000000 0.380535 O\n0.000000 0.180407 0.619465 O\n0.000000 0.819593 0.619465 O\n0.680407 0.500000 0.619465 O\n0.319593 0.500000 0.619465 O\n",
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{
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"structure_string": "Ag80 Te32 Cl16\n1.0\n7.792915 0.000000 0.000000\n0.000000 19.718659 0.000000\n0.000000 0.011022 19.899007\nAg Te Cl\n80 32 16\ndirect\n0.009913 0.867902 0.736774 Ag\n0.124538 0.987976 0.089216 Ag\n0.755624 0.204880 0.591797 Ag\n0.255624 0.795120 0.908203 Ag\n0.108287 0.932261 0.499908 Ag\n0.875462 0.012024 0.910784 Ag\n0.857779 0.437191 0.682130 Ag\n0.787245 0.718553 0.077266 Ag\n0.949979 0.833982 0.594969 Ag\n0.114763 0.834003 0.234495 Ag\n0.991322 0.385783 0.236681 Ag\n0.355305 0.067886 0.313485 Ag\n0.090167 0.259001 0.169825 Ag\n0.409833 0.259001 0.669825 Ag\n0.642221 0.437191 0.182130 Ag\n0.490087 0.867902 0.236774 Ag\n0.579521 0.310413 0.521671 Ag\n0.979378 0.491549 0.129744 Ag\n0.255421 0.181323 0.530494 Ag\n0.563646 0.283765 0.988317 Ag\n0.436354 0.716235 0.011683 Ag\n0.990087 0.132098 0.263226 Ag\n0.357779 0.562809 0.817870 Ag\n0.744376 0.204880 0.091797 Ag\n0.550021 0.833982 0.094969 Ag\n0.015682 0.019393 0.367884 Ag\n0.479378 0.508451 0.370256 Ag\n0.491322 0.614217 0.263319 Ag\n0.628521 0.659342 0.764833 Ag\n0.287245 0.281447 0.422734 Ag\n0.385237 0.834003 0.734495 Ag\n0.111723 0.498456 0.581395 Ag\n0.644695 0.932114 0.686515 Ag\n0.755421 0.818677 0.969506 Ag\n0.611723 0.501544 0.918605 Ag\n0.244579 0.181323 0.030494 Ag\n0.920479 0.310413 0.021671 Ag\n0.891713 0.067739 0.500092 Ag\n0.984318 0.980607 0.632116 Ag\n0.375462 0.987976 0.589216 Ag\n0.020622 0.508451 0.870256 Ag\n0.909833 0.740999 0.830175 Ag\n0.212755 0.281447 0.922734 Ag\n0.744579 0.818677 0.469506 Ag\n0.520622 0.491549 0.629744 Ag\n0.624538 0.012024 0.410784 Ag\n0.388277 0.498456 0.081395 Ag\n0.888277 0.501544 0.418605 Ag\n0.888417 0.561625 0.999599 Ag\n0.508678 0.385783 0.736681 Ag\n0.371479 0.340658 0.235167 Ag\n0.063646 0.716235 0.511683 Ag\n0.712755 0.718553 0.577266 Ag\n0.515682 0.980607 0.132116 Ag\n0.590167 0.740999 0.330175 Ag\n0.614763 0.165997 0.265505 Ag\n0.128521 0.340658 0.735167 Ag\n0.391713 0.932261 0.999908 Ag\n0.808696 0.266987 0.341230 Ag\n0.936354 0.283765 0.488317 Ag\n0.079521 0.689587 0.978329 Ag\n0.050021 0.166018 0.405031 Ag\n0.611583 0.561625 0.499599 Ag\n0.871479 0.659342 0.264833 Ag\n0.885237 0.165997 0.765505 Ag\n0.191304 0.733013 0.658770 Ag\n0.484318 0.019393 0.867884 Ag\n0.509913 0.132098 0.763226 Ag\n0.388417 0.438375 0.500401 Ag\n0.142221 0.562809 0.317870 Ag\n0.855305 0.932114 0.186515 Ag\n0.691304 0.266987 0.841230 Ag\n0.144695 0.067886 0.813485 Ag\n0.008678 0.614217 0.763319 Ag\n0.111583 0.438375 0.000401 Ag\n0.608287 0.067739 0.000092 Ag\n0.244376 0.795120 0.408203 Ag\n0.308696 0.733013 0.158770 Ag\n0.449979 0.166018 0.905031 Ag\n0.420479 0.689587 0.478329 Ag\n0.728775 0.436795 0.041570 Te\n0.731976 0.525710 0.785857 Te\n0.716284 0.945789 0.540223 Te\n0.762508 0.033089 0.778952 Te\n0.773793 0.678223 0.437949 Te\n0.770997 0.291853 0.704481 Te\n0.262508 0.966911 0.721048 Te\n0.227467 0.212654 0.795528 Te\n0.231976 0.474290 0.714143 Te\n0.727467 0.787346 0.704472 Te\n0.195863 0.815277 0.050286 Te\n0.771225 0.436795 0.541570 Te\n0.772533 0.787346 0.204472 Te\n0.768024 0.525710 0.285857 Te\n0.726207 0.678223 0.937949 Te\n0.729003 0.291853 0.204481 Te\n0.272533 0.212654 0.295529 Te\n0.268024 0.474290 0.214143 Te\n0.304137 0.815277 0.550286 Te\n0.271225 0.563205 0.958430 Te\n0.737492 0.033089 0.278952 Te\n0.226207 0.321777 0.562051 Te\n0.237492 0.966911 0.221048 Te\n0.229003 0.708147 0.295519 Te\n0.216284 0.054211 0.959777 Te\n0.804137 0.184723 0.949714 Te\n0.270997 0.708147 0.795519 Te\n0.273793 0.321777 0.062051 Te\n0.695863 0.184723 0.449714 Te\n0.283716 0.054211 0.459777 Te\n0.783716 0.945789 0.040223 Te\n0.228775 0.563205 0.458430 Te\n0.986293 0.369967 0.872382 Cl\n0.986607 0.876831 0.874771 Cl\n0.011867 0.374563 0.376922 Cl\n0.513190 0.878666 0.879222 Cl\n0.486607 0.123169 0.625229 Cl\n0.488133 0.374563 0.876922 Cl\n0.511867 0.625437 0.123078 Cl\n0.486810 0.121334 0.120778 Cl\n0.013707 0.630033 0.127618 Cl\n0.986810 0.878666 0.379222 Cl\n0.513707 0.369967 0.372382 Cl\n0.988133 0.625437 0.623078 Cl\n0.486293 0.630033 0.627618 Cl\n0.013393 0.123169 0.125229 Cl\n0.513393 0.876831 0.374771 Cl\n0.013190 0.121334 0.620778 Cl\n",
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"formula_full": "Ag80 Te32 Cl16",
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{
"id": "mp-573465",
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"structure_string": "Ag40 Te16 Cl8\n1.0\n7.797811 0.000000 0.000000\n0.000000 14.016486 0.000000\n0.000000 0.000000 14.100852\nAg Te Cl\n40 16 8\ndirect\n0.871240 0.928581 0.921224 Ag\n0.008976 0.641518 0.107938 Ag\n0.128760 0.071419 0.078776 Ag\n0.491024 0.358482 0.607938 Ag\n0.624502 0.899583 0.079614 Ag\n0.628760 0.428581 0.421224 Ag\n0.124502 0.600417 0.420386 Ag\n0.875498 0.399583 0.579614 Ag\n0.628760 0.071419 0.421224 Ag\n0.375498 0.100417 0.920386 Ag\n0.371240 0.928581 0.578776 Ag\n0.565030 0.750000 0.573418 Ag\n0.508976 0.641518 0.392062 Ag\n0.707265 0.353675 0.203309 Ag\n0.065030 0.750000 0.926582 Ag\n0.292735 0.853675 0.796691 Ag\n0.434970 0.250000 0.426582 Ag\n0.934970 0.250000 0.073418 Ag\n0.142638 0.250000 0.619503 Ag\n0.871240 0.571419 0.921224 Ag\n0.642638 0.250000 0.880497 Ag\n0.792735 0.853675 0.703309 Ag\n0.624502 0.600417 0.079614 Ag\n0.008976 0.858482 0.107938 Ag\n0.128760 0.428581 0.078776 Ag\n0.357362 0.750000 0.119503 Ag\n0.292735 0.646325 0.796691 Ag\n0.375498 0.399583 0.920386 Ag\n0.207265 0.146325 0.296691 Ag\n0.857362 0.750000 0.380497 Ag\n0.991024 0.358482 0.892062 Ag\n0.707265 0.146325 0.203309 Ag\n0.491024 0.141518 0.607938 Ag\n0.371240 0.571419 0.578776 Ag\n0.508976 0.858482 0.392062 Ag\n0.124502 0.899583 0.420386 Ag\n0.792735 0.646325 0.703309 Ag\n0.875498 0.100417 0.579614 Ag\n0.991024 0.141518 0.892062 Ag\n0.207265 0.353675 0.296691 Ag\n0.754545 0.250000 0.689787 Te\n0.211503 0.410577 0.490651 Te\n0.285370 0.250000 0.132420 Te\n0.788497 0.910577 0.509349 Te\n0.785370 0.250000 0.367580 Te\n0.254545 0.250000 0.810213 Te\n0.711503 0.089423 0.009349 Te\n0.214630 0.750000 0.632420 Te\n0.288497 0.589423 0.990651 Te\n0.288497 0.910577 0.990651 Te\n0.711503 0.410577 0.009349 Te\n0.714630 0.750000 0.867580 Te\n0.211503 0.089423 0.490651 Te\n0.745455 0.750000 0.189787 Te\n0.245455 0.750000 0.310213 Te\n0.788497 0.589423 0.509349 Te\n0.511224 0.503239 0.745310 Cl\n0.988776 0.496761 0.245310 Cl\n0.988776 0.003239 0.245310 Cl\n0.011224 0.996761 0.754690 Cl\n0.011224 0.503239 0.754690 Cl\n0.488776 0.496761 0.254690 Cl\n0.488776 0.003239 0.254690 Cl\n0.511224 0.996761 0.745310 Cl\n",
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{
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"structure_string": "Ag40 Te16 Br8\n1.0\n7.781336 0.000000 0.000000\n0.000000 14.183921 0.000000\n0.000000 0.000000 14.239499\nAg Te Br\n40 16 8\ndirect\n0.206528 0.352200 0.700252 Ag\n0.793472 0.647800 0.299748 Ag\n0.706528 0.147800 0.799748 Ag\n0.293472 0.852200 0.200252 Ag\n0.434983 0.250000 0.571663 Ag\n0.565017 0.750000 0.428337 Ag\n0.934983 0.250000 0.928337 Ag\n0.065017 0.750000 0.071663 Ag\n0.131501 0.073192 0.921302 Ag\n0.868499 0.926808 0.078698 Ag\n0.631501 0.426808 0.578698 Ag\n0.368499 0.573192 0.421302 Ag\n0.007078 0.857527 0.894010 Ag\n0.992922 0.142473 0.105990 Ag\n0.507078 0.642473 0.605990 Ag\n0.492922 0.357527 0.394010 Ag\n0.354047 0.750000 0.879651 Ag\n0.645953 0.250000 0.120349 Ag\n0.854047 0.750000 0.620349 Ag\n0.145953 0.250000 0.379651 Ag\n0.007078 0.642473 0.894010 Ag\n0.992922 0.357527 0.105990 Ag\n0.507078 0.857527 0.605990 Ag\n0.492922 0.142473 0.394010 Ag\n0.624425 0.601071 0.921007 Ag\n0.375575 0.398929 0.078993 Ag\n0.124425 0.898929 0.578993 Ag\n0.875575 0.101071 0.421007 Ag\n0.124425 0.601071 0.578993 Ag\n0.875575 0.398929 0.421007 Ag\n0.624425 0.898929 0.921007 Ag\n0.375575 0.101071 0.078993 Ag\n0.706528 0.352200 0.799748 Ag\n0.293472 0.647800 0.200252 Ag\n0.206528 0.147800 0.700252 Ag\n0.793472 0.852200 0.299748 Ag\n0.131501 0.426808 0.921302 Ag\n0.868499 0.573192 0.078698 Ag\n0.631501 0.073192 0.578698 Ag\n0.368499 0.926808 0.421302 Ag\n0.212373 0.411528 0.508695 Te\n0.787627 0.588472 0.491305 Te\n0.712373 0.088472 0.991305 Te\n0.287627 0.911528 0.008695 Te\n0.212373 0.088472 0.508695 Te\n0.787627 0.911528 0.491305 Te\n0.712373 0.411528 0.991305 Te\n0.287627 0.588472 0.008695 Te\n0.241736 0.750000 0.688223 Te\n0.758264 0.250000 0.311777 Te\n0.741736 0.750000 0.811777 Te\n0.258264 0.250000 0.188223 Te\n0.781553 0.250000 0.636024 Te\n0.218447 0.750000 0.363976 Te\n0.281553 0.250000 0.863976 Te\n0.718447 0.750000 0.136024 Te\n0.479624 0.499229 0.748791 Br\n0.520376 0.500771 0.251209 Br\n0.979624 0.000771 0.751209 Br\n0.020376 0.999229 0.248791 Br\n0.479624 0.000771 0.748791 Br\n0.520376 0.999229 0.251209 Br\n0.979624 0.499229 0.751209 Br\n0.020376 0.500771 0.248791 Br\n",
"nsites": 64,
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],
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{
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