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{
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{
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"structure_string": "Li6 V2 O4 F4\n1.0\n5.970592 0.000000 0.000000\n0.000000 5.010062 0.000000\n0.000000 1.561105 4.873764\nLi V O F\n6 2 4 4\ndirect\n0.114687 0.250000 0.500000 Li\n0.641396 0.250000 0.500000 Li\n0.375080 0.250000 0.000000 Li\n0.358604 0.750000 0.500000 Li\n0.885313 0.750000 0.500000 Li\n0.624920 0.750000 0.000000 Li\n0.901643 0.250000 0.000000 V\n0.098357 0.750000 0.000000 V\n0.870780 0.003604 0.762857 O\n0.870780 0.496396 0.237143 O\n0.129220 0.503604 0.762857 O\n0.129220 0.996396 0.237143 O\n0.628676 0.007335 0.244962 F\n0.371324 0.507335 0.244962 F\n0.628676 0.492665 0.755038 F\n0.371324 0.992665 0.755038 F\n",
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{
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"structure_string": "Na4 B10 H10 O24\n1.0\n6.629415 0.000000 0.000000\n2.659620 8.209057 0.000000\n2.194250 2.470567 9.063852\nNa B H O\n4 10 10 24\ndirect\n0.960768 0.903606 0.365895 Na\n0.039232 0.096394 0.634105 Na\n0.433693 0.585927 0.155390 Na\n0.566307 0.414073 0.844610 Na\n0.854197 0.334295 0.161000 B\n0.145803 0.665705 0.839000 B\n0.181477 0.256415 0.285322 B\n0.818523 0.743585 0.714678 B\n0.846357 0.462778 0.359719 B\n0.153643 0.537222 0.640281 B\n0.374181 0.953310 0.371266 B\n0.625819 0.046690 0.628734 B\n0.581853 0.157866 0.263236 B\n0.418147 0.842134 0.736764 B\n0.841035 0.512601 0.957814 H\n0.158965 0.487399 0.042186 H\n0.814350 0.583621 0.515197 H\n0.185650 0.416379 0.484803 H\n0.495909 0.703379 0.423761 H\n0.504091 0.296621 0.576239 H\n0.718662 0.803372 0.976385 H\n0.281338 0.196628 0.023615 H\n0.078900 0.753279 0.069711 H\n0.921100 0.246721 0.930289 H\n0.785692 0.176973 0.224114 O\n0.214308 0.823027 0.775886 O\n0.790589 0.409292 0.012338 O\n0.209411 0.590708 0.987662 O\n0.088195 0.301577 0.150004 O\n0.911805 0.698423 0.849996 O\n0.747329 0.455416 0.253296 O\n0.252671 0.544584 0.746704 O\n0.733818 0.572265 0.444737 O\n0.266182 0.427735 0.555263 O\n0.051103 0.366327 0.384682 O\n0.948897 0.633673 0.615318 O\n0.186676 0.078947 0.368978 O\n0.813324 0.921053 0.631022 O\n0.398367 0.285484 0.245455 O\n0.601633 0.714516 0.754545 O\n0.355309 0.791472 0.414987 O\n0.644691 0.208528 0.585013 O\n0.574219 0.988776 0.330853 O\n0.425781 0.011224 0.669147 O\n0.589392 0.828918 0.053600 O\n0.410608 0.171082 0.946400 O\n0.027992 0.812053 0.151587 O\n0.972008 0.187947 0.848413 O\n",
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{
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"structure_string": "Cr4 Hg4 H4 O18\n1.0\n2.665134 6.028570 0.000000\n-2.665134 6.028570 0.000000\n0.000000 4.373505 12.788110\nCr Hg H O\n4 4 4 18\ndirect\n0.160868 0.541244 0.598271 Cr\n0.458756 0.839132 0.901729 Cr\n0.839132 0.458756 0.401729 Cr\n0.541244 0.160868 0.098271 Cr\n0.345835 0.901918 0.624647 Hg\n0.098082 0.654165 0.875353 Hg\n0.654165 0.098082 0.375353 Hg\n0.901918 0.345835 0.124647 Hg\n0.776455 0.294155 0.788658 H\n0.705845 0.223545 0.711342 H\n0.223545 0.705845 0.211342 H\n0.294155 0.776455 0.288658 H\n0.310980 0.590113 0.665206 O\n0.409887 0.689020 0.834794 O\n0.689020 0.409887 0.334794 O\n0.590113 0.310980 0.165206 O\n0.878317 0.612172 0.667751 O\n0.387828 0.121683 0.832249 O\n0.121683 0.387828 0.332249 O\n0.612172 0.878317 0.167751 O\n0.395720 0.201759 0.573487 O\n0.798241 0.604280 0.926513 O\n0.604280 0.798241 0.426513 O\n0.201759 0.395720 0.073487 O\n0.091869 0.738167 0.486652 O\n0.261833 0.908131 0.013348 O\n0.908131 0.261833 0.513348 O\n0.738167 0.091869 0.986652 O\n0.854626 0.145374 0.750000 O\n0.145374 0.854626 0.250000 O\n",
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{
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"structure_string": "Li6 Cu1 B4 O10\n1.0\n-3.365293 0.000000 0.000000\n0.445804 6.753260 0.000000\n-0.065318 -1.818087 -9.187840\nLi Cu B O\n6 1 4 10\ndirect\n0.571422 0.791093 0.469979 Li\n0.428578 0.208907 0.530021 Li\n0.029701 0.519361 0.352743 Li\n0.970299 0.480639 0.647257 Li\n0.485331 0.347145 0.123881 Li\n0.514669 0.652855 0.876119 Li\n0.000000 0.000000 0.000000 Cu\n0.615519 0.781081 0.210182 B\n0.384481 0.218919 0.789818 B\n0.876416 0.147401 0.313821 B\n0.123584 0.852599 0.686179 B\n0.645958 0.793519 0.068723 O\n0.354042 0.206481 0.931277 O\n0.975310 0.201511 0.184281 O\n0.024690 0.798489 0.815719 O\n0.680392 0.958666 0.323353 O\n0.319608 0.041334 0.676647 O\n0.529638 0.609033 0.264942 O\n0.470362 0.390967 0.735058 O\n0.942468 0.279014 0.443752 O\n0.057532 0.720986 0.556248 O\n",
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{
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"structure_string": "Na8 Th2 Mo8 O32\n1.0\n-5.780337 5.780337 6.069915\n5.780337 -5.780337 6.069915\n5.780337 5.780337 -6.069915\nNa Th Mo O\n8 2 8 32\ndirect\n0.245704 0.086554 0.395966 Na\n0.599738 0.495704 0.659150 Na\n0.059412 0.400262 0.895966 Na\n0.836554 0.940588 0.340850 Na\n0.504296 0.163446 0.104034 Na\n0.150262 0.754296 0.840850 Na\n0.690588 0.849738 0.604034 Na\n0.913446 0.309412 0.159150 Na\n0.250000 0.750000 0.500000 Th\n0.500000 0.500000 0.000000 Th\n0.814434 0.584596 0.412214 Mo\n0.577618 0.847780 0.912214 Mo\n0.172382 0.402220 0.587786 Mo\n0.597780 0.185566 0.770161 Mo\n0.935566 0.665404 0.087786 Mo\n0.415404 0.827618 0.229839 Mo\n0.334595 0.422382 0.270161 Mo\n0.152220 0.064434 0.729839 Mo\n0.215920 0.018542 0.885157 O\n0.069088 0.190948 0.464791 O\n0.598521 0.771133 0.052124 O\n0.009686 0.598345 0.232256 O\n0.348345 0.616088 0.088659 O\n0.521133 0.969009 0.672612 O\n0.768542 0.383384 0.302622 O\n0.133384 0.330763 0.114843 O\n0.023843 0.645703 0.964791 O\n0.151479 0.478867 0.447876 O\n0.228867 0.280991 0.827388 O\n0.719009 0.546397 0.947876 O\n0.030991 0.703603 0.552124 O\n0.453603 0.401479 0.172612 O\n0.981458 0.866616 0.197378 O\n0.669237 0.784080 0.802622 O\n0.527429 0.259686 0.911341 O\n0.680912 0.059052 0.035209 O\n0.809052 0.273843 0.878140 O\n0.534080 0.231458 0.614843 O\n0.726157 0.604297 0.535209 O\n0.080763 0.465920 0.697378 O\n0.401655 0.633912 0.411341 O\n0.940948 0.976157 0.621860 O\n0.222571 0.990314 0.588659 O\n0.296397 0.848521 0.327388 O\n0.354297 0.319088 0.378140 O\n0.395703 0.930912 0.121860 O\n0.366088 0.777429 0.767744 O\n0.383912 0.472571 0.732256 O\n0.740314 0.651655 0.267744 O\n0.616616 0.919237 0.385157 O\n",
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{
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{
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{
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{
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"structure_string": "Tm1 Cr2 Fe10\n1.0\n0.000000 0.000000 4.690115\n-4.215865 4.185310 2.345058\n-4.215865 -4.185310 -2.345058\nTm Cr Fe\n1 2 10\ndirect\n0.000000 0.000000 0.000000 Tm\n0.000000 0.367269 0.367269 Cr\n0.000000 0.632731 0.632731 Cr\n0.724312 0.775688 0.224312 Fe\n0.275688 0.224312 0.775688 Fe\n0.500000 0.773554 0.773554 Fe\n0.500000 0.226446 0.226446 Fe\n0.500000 0.000000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.641093 0.358907 0.641093 Fe\n0.358907 0.641093 0.358907 Fe\n",
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"density": 8.341016513511653,
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"formula_full": "Tm1 Cr2 Fe10",
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{
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"structure_string": "Mg1 Mn6 Nb4 O18\n1.0\n5.367558 -0.074728 -0.257555\n-2.747113 4.786963 0.464523\n-0.730381 1.106840 15.262002\nMg Mn Nb O\n1 6 4 18\ndirect\n0.023127 0.927027 0.512170 Mg\n0.597975 0.319803 0.681924 Mn\n0.677418 0.397485 0.978619 Mn\n0.699010 0.272230 0.453908 Mn\n0.348825 0.575989 0.487957 Mn\n0.351174 0.722375 0.006430 Mn\n0.678635 0.354965 0.180826 Mn\n0.005273 0.116551 0.870932 Nb\n0.014719 0.003752 0.138696 Nb\n0.933067 0.967855 0.678973 Nb\n0.019891 0.994740 0.331780 Nb\n0.373800 0.349304 0.089733 O\n0.691207 0.777865 0.925736 O\n0.958672 0.243970 0.235913 O\n0.343724 0.077825 0.245185 O\n0.977991 0.675110 0.094175 O\n0.670215 0.645023 0.588516 O\n0.722140 0.059459 0.753181 O\n0.029746 0.411499 0.922705 O\n0.044067 0.686751 0.427172 O\n0.296427 0.031794 0.617030 O\n0.244039 0.205451 0.760613 O\n0.935415 0.218729 0.563774 O\n0.805391 0.707212 0.246868 O\n0.297100 0.062432 0.936604 O\n0.711956 0.049825 0.081064 O\n0.719575 0.942996 0.407606 O\n0.312105 0.253430 0.416813 O\n0.850652 0.615216 0.746933 O\n",
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"formula_full": "Mg1 Mn6 Nb4 O18",
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{
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"structure_string": "W3 O9\n1.0\n3.754078 -6.502254 0.000000\n3.754078 6.502254 0.000000\n0.000000 0.000000 3.862553\nW O\n3 9\ndirect\n0.000000 0.500000 0.000000 W\n0.500000 0.000000 0.000000 W\n0.500000 0.500000 0.000000 W\n0.786072 0.213928 0.000000 O\n0.786072 0.572144 0.000000 O\n0.213928 0.786072 0.000000 O\n0.572144 0.786072 0.000000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.427856 0.213928 0.000000 O\n0.213928 0.427856 0.000000 O\n",
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"formula_full": "W3 O9",
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]
}