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{
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{
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{
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"structure_string": "Mg12 Si12 W8 O48\n1.0\n-6.048198 6.048198 6.048198\n6.048198 -6.048198 6.048198\n6.048198 6.048198 -6.048198\nMg Si W O\n12 12 8 48\ndirect\n0.250000 0.375000 0.125000 Mg\n0.750000 0.125000 0.375000 Mg\n0.375000 0.125000 0.250000 Mg\n0.125000 0.375000 0.750000 Mg\n0.250000 0.875000 0.625000 Mg\n0.125000 0.250000 0.375000 Mg\n0.625000 0.250000 0.875000 Mg\n0.750000 0.625000 0.875000 Mg\n0.875000 0.750000 0.625000 Mg\n0.875000 0.625000 0.250000 Mg\n0.625000 0.875000 0.750000 Mg\n0.375000 0.750000 0.125000 Mg\n0.125000 0.750000 0.875000 Si\n0.875000 0.250000 0.125000 Si\n0.750000 0.375000 0.625000 Si\n0.125000 0.875000 0.250000 Si\n0.250000 0.125000 0.875000 Si\n0.375000 0.625000 0.750000 Si\n0.375000 0.250000 0.625000 Si\n0.875000 0.125000 0.750000 Si\n0.625000 0.375000 0.250000 Si\n0.750000 0.875000 0.125000 Si\n0.250000 0.625000 0.375000 Si\n0.625000 0.750000 0.375000 Si\n0.500000 0.000000 0.000000 W\n0.500000 0.500000 0.000000 W\n0.000000 0.500000 0.500000 W\n0.000000 0.000000 0.500000 W\n0.500000 0.500000 0.500000 W\n0.000000 0.500000 0.000000 W\n0.500000 0.000000 0.500000 W\n0.000000 0.000000 0.000000 W\n0.594170 0.894752 0.372303 O\n0.372303 0.594170 0.894752 O\n0.278133 0.300582 0.905830 O\n0.477551 0.605248 0.199418 O\n0.300582 0.894752 0.022449 O\n0.127697 0.022449 0.221867 O\n0.372303 0.278133 0.477551 O\n0.894752 0.372303 0.594170 O\n0.199418 0.221867 0.594170 O\n0.477551 0.372303 0.278133 O\n0.894752 0.022449 0.300582 O\n0.605248 0.905830 0.127697 O\n0.905830 0.127697 0.605248 O\n0.278133 0.477551 0.372303 O\n0.594170 0.199418 0.221867 O\n0.221867 0.594170 0.199418 O\n0.022449 0.300582 0.894752 O\n0.905830 0.278133 0.300582 O\n0.022449 0.221867 0.127697 O\n0.800582 0.778133 0.405830 O\n0.199418 0.477551 0.605248 O\n0.605248 0.199418 0.477551 O\n0.221867 0.127697 0.022449 O\n0.127697 0.605248 0.905830 O\n0.405830 0.105248 0.627697 O\n0.627697 0.405830 0.105248 O\n0.721867 0.699418 0.094170 O\n0.522449 0.394752 0.800582 O\n0.699418 0.105248 0.977551 O\n0.872303 0.977551 0.778133 O\n0.627697 0.721867 0.522449 O\n0.105248 0.627697 0.405830 O\n0.872303 0.394752 0.094170 O\n0.778133 0.872303 0.977551 O\n0.394752 0.800582 0.522449 O\n0.699418 0.094170 0.721867 O\n0.800582 0.522449 0.394752 O\n0.977551 0.778133 0.872303 O\n0.094170 0.721867 0.699418 O\n0.977551 0.699418 0.105248 O\n0.778133 0.405830 0.800582 O\n0.405830 0.800582 0.778133 O\n0.721867 0.522449 0.627697 O\n0.094170 0.872303 0.394752 O\n0.394752 0.094170 0.872303 O\n0.105248 0.977551 0.699418 O\n0.522449 0.627697 0.721867 O\n0.300582 0.905830 0.278133 O\n",
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{
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{
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{
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"structure_string": "K8 Ir4 C4 Br20 O4\n1.0\n7.448687 0.000000 0.000000\n0.000000 10.646676 0.000000\n0.000000 0.000000 15.317833\nK Ir C Br O\n8 4 4 20 4\ndirect\n0.850183 0.498804 0.348294 K\n0.350183 0.998804 0.151706 K\n0.149817 0.998804 0.651706 K\n0.649817 0.498804 0.848294 K\n0.350183 0.501196 0.151706 K\n0.649817 0.001196 0.848294 K\n0.149817 0.501196 0.651706 K\n0.850183 0.001196 0.348294 K\n0.199800 0.250000 0.875806 Ir\n0.800200 0.750000 0.124194 Ir\n0.699800 0.750000 0.624194 Ir\n0.300200 0.250000 0.375806 Ir\n0.952430 0.250000 0.049983 C\n0.452430 0.750000 0.450017 C\n0.047570 0.750000 0.950017 C\n0.547570 0.250000 0.549983 C\n0.694746 0.986885 0.623176 Br\n0.805254 0.513115 0.123176 Br\n0.571956 0.250000 0.277901 Br\n0.194746 0.013115 0.876824 Br\n0.305254 0.013115 0.376824 Br\n0.194746 0.486885 0.876824 Br\n0.967856 0.750000 0.522445 Br\n0.602167 0.750000 0.250640 Br\n0.467856 0.250000 0.977555 Br\n0.397833 0.250000 0.749360 Br\n0.694746 0.513115 0.623176 Br\n0.305254 0.486885 0.376824 Br\n0.102167 0.250000 0.249360 Br\n0.428044 0.750000 0.722099 Br\n0.805254 0.986885 0.123176 Br\n0.928044 0.250000 0.777901 Br\n0.532144 0.750000 0.022445 Br\n0.897833 0.750000 0.750640 Br\n0.071956 0.750000 0.222099 Br\n0.032144 0.250000 0.477555 Br\n0.963818 0.750000 0.013655 O\n0.463818 0.250000 0.486345 O\n0.536182 0.750000 0.513655 O\n0.036182 0.250000 0.986345 O\n",
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