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{
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{
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{
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{
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{
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"structure_string": "Sm4 Cd4 B20 O40\n1.0\n7.980287 0.000000 0.000000\n0.000000 8.708578 0.000000\n0.000000 8.363709 9.631290\nSm Cd B O\n4 4 20 40\ndirect\n0.183091 0.952036 0.240309 Sm\n0.683091 0.047964 0.259691 Sm\n0.816909 0.047964 0.759691 Sm\n0.316909 0.952036 0.740309 Sm\n0.405045 0.473088 0.128742 Cd\n0.905045 0.526912 0.371258 Cd\n0.594955 0.526912 0.871258 Cd\n0.094955 0.473088 0.628742 Cd\n0.573797 0.668341 0.247815 B\n0.174617 0.529186 0.905549 B\n0.674618 0.470814 0.594451 B\n0.825383 0.470814 0.094451 B\n0.325383 0.529186 0.405549 B\n0.894467 0.854724 0.488950 B\n0.394467 0.145276 0.011050 B\n0.105533 0.145276 0.511050 B\n0.605533 0.854724 0.988950 B\n0.073797 0.331659 0.252185 B\n0.426203 0.331659 0.752185 B\n0.926203 0.668341 0.747815 B\n0.323815 0.077621 0.405191 B\n0.823815 0.922379 0.094809 B\n0.676185 0.922379 0.594809 B\n0.176185 0.077621 0.905191 B\n0.530349 0.279059 0.441788 B\n0.030349 0.720941 0.058212 B\n0.469651 0.720941 0.558212 B\n0.969651 0.279059 0.941788 B\n0.205365 0.184929 0.282310 O\n0.670876 0.413507 0.080564 O\n0.170876 0.586493 0.419436 O\n0.329124 0.586493 0.919436 O\n0.829124 0.413507 0.580564 O\n0.440079 0.122860 0.123342 O\n0.940079 0.877140 0.376658 O\n0.559921 0.877140 0.876658 O\n0.705365 0.815071 0.217690 O\n0.059921 0.122860 0.623342 O\n0.294635 0.184929 0.782310 O\n0.794635 0.815071 0.717690 O\n0.532116 0.712584 0.116541 O\n0.032116 0.287416 0.383459 O\n0.467884 0.287416 0.883459 O\n0.967884 0.712584 0.616541 O\n0.418625 0.693082 0.297609 O\n0.918625 0.306918 0.202391 O\n0.581375 0.306918 0.702391 O\n0.081375 0.693082 0.797609 O\n0.637733 0.458922 0.350499 O\n0.137733 0.541078 0.149501 O\n0.362267 0.541078 0.649501 O\n0.862267 0.458922 0.850499 O\n0.466122 0.218403 0.362782 O\n0.966122 0.781597 0.137218 O\n0.533878 0.781597 0.637218 O\n0.033878 0.218403 0.862782 O\n0.383919 0.897007 0.426980 O\n0.883919 0.102993 0.073020 O\n0.616081 0.102993 0.573020 O\n0.117081 0.332362 0.987868 O\n0.234209 0.022722 0.527076 O\n0.734209 0.977278 0.972924 O\n0.765791 0.977278 0.472924 O\n0.265791 0.022722 0.027076 O\n0.382919 0.332362 0.487868 O\n0.882919 0.667638 0.012132 O\n0.617081 0.667638 0.512132 O\n0.116081 0.897007 0.926980 O\n",
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{
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"structure_string": "K4 Mo30 Se38\n1.0\n-4.950714 -8.574889 0.000000\n4.950714 -8.574889 0.000000\n0.000000 -5.716593 19.555934\nK Mo Se\n4 30 38\ndirect\n0.614764 0.614764 0.155707 K\n0.114764 0.114764 0.655707 K\n0.385236 0.385236 0.844293 K\n0.885236 0.885236 0.344293 K\n0.497745 0.686227 0.441679 Mo\n0.686227 0.374349 0.441679 Mo\n0.374349 0.497745 0.441679 Mo\n0.997745 0.874349 0.941679 Mo\n0.874349 0.186227 0.941679 Mo\n0.186227 0.997745 0.941679 Mo\n0.502255 0.313773 0.558321 Mo\n0.313773 0.625651 0.558321 Mo\n0.625651 0.502255 0.558321 Mo\n0.002255 0.125651 0.058321 Mo\n0.125651 0.813773 0.058321 Mo\n0.813773 0.002255 0.058321 Mo\n0.722643 0.859797 0.867659 Mo\n0.859797 0.549901 0.867659 Mo\n0.549901 0.722643 0.867659 Mo\n0.222643 0.049901 0.367659 Mo\n0.049901 0.359797 0.367659 Mo\n0.359797 0.222643 0.367659 Mo\n0.277357 0.140203 0.132341 Mo\n0.140203 0.450099 0.132341 Mo\n0.450099 0.277357 0.132341 Mo\n0.777357 0.950099 0.632341 Mo\n0.950099 0.640203 0.632341 Mo\n0.640203 0.777357 0.632341 Mo\n0.592635 0.907365 0.750000 Mo\n0.907365 0.750000 0.750000 Mo\n0.750000 0.592635 0.750000 Mo\n0.092635 0.250000 0.250000 Mo\n0.250000 0.407365 0.250000 Mo\n0.407365 0.092635 0.250000 Mo\n0.800899 0.554804 0.450106 Se\n0.554804 0.194192 0.450106 Se\n0.194192 0.800899 0.450106 Se\n0.300899 0.694192 0.950106 Se\n0.694192 0.054804 0.950106 Se\n0.054804 0.300899 0.950106 Se\n0.199101 0.445196 0.549894 Se\n0.445196 0.805808 0.549894 Se\n0.805808 0.199101 0.549894 Se\n0.699101 0.305808 0.049894 Se\n0.305808 0.945196 0.049894 Se\n0.945196 0.699101 0.049894 Se\n0.422311 0.030855 0.857330 Se\n0.030855 0.689504 0.857330 Se\n0.689504 0.422311 0.857330 Se\n0.922311 0.189504 0.357330 Se\n0.189504 0.530855 0.357330 Se\n0.530855 0.922311 0.357330 Se\n0.577689 0.969145 0.142670 Se\n0.969145 0.310496 0.142670 Se\n0.310496 0.577689 0.142670 Se\n0.077689 0.810496 0.642670 Se\n0.810496 0.469145 0.642670 Se\n0.469145 0.077689 0.642670 Se\n0.053855 0.446145 0.750000 Se\n0.446145 0.750000 0.750000 Se\n0.750000 0.053855 0.750000 Se\n0.553855 0.250000 0.250000 Se\n0.250000 0.946145 0.250000 Se\n0.946145 0.553855 0.250000 Se\n0.554124 0.554124 0.337628 Se\n0.054124 0.054124 0.837628 Se\n0.445876 0.445876 0.662372 Se\n0.945876 0.945876 0.162372 Se\n0.676066 0.676066 0.971802 Se\n0.176066 0.176066 0.471802 Se\n0.323934 0.323934 0.028198 Se\n0.823934 0.823934 0.528198 Se\n",
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