0 mol 11 unq 0 iso 0 dist 9.62742 6.20956 4.44069 9.42607 4.54527 6.79033 5.51815 10.4984 6.89666 10.2486 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 7.32126 6.46901 4.32471 9.30547 4.19866 6.97513 6.124 8.37969 9.77553 11.2009 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 6.74134 7.98824 3.80683 9.42329 6.77296 3.94577 10.5571 9.79714 9.71952 7.28257 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 6.74134 9.42329 6.77296 7.98824 3.80683 3.94577 10.5571 9.79714 7.28257 9.71952 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 8.78439 4.9418 8.55092 9.71805 7.25051 8.6162 5.88774 11.8711 4.99966 13.4168 numMergedOcc 0
5 mol 103 unq 1 iso 0 dist 8.78439 4.9418 8.55092 5.7953 3.91289 7.44304 5.88774 11.8711 4.99966 9.52083 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 5.55005 5.93206 4.72156 7.73529 3.90222 6.14668 6.32175 11.0717 8.73648 12.2141 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 8.98076 6.9952 10.461 9.30054 4.22065 9.9673 4.4932 11.1368 8.67193 12.7623 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 8.27247 5.67586 4.25621 7.53235 5.02768 7.22219 4.97206 10.2869 7.26897 10.9727 numMergedOcc 0
9 mol 154 unq 1 iso 0 dist 7.80275 5.67586 6.83168 7.53235 4.27253 7.22219 4.97206 12.0834 7.26897 10.9727 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 9.37716 8.85187 8.19458 7.75061 10.6298 14.4384 9.90397 15.0991 8.06326 16.5426 numMergedOcc 0
11 mol 176 unq 1 iso 0 dist 9.37716 8.85187 8.19458 9.11609 5.41212 3.71917 9.90397 15.0991 8.06326 11.4051 numMergedOcc 0
12 mol 176 unq 2 iso 0 dist 9.37716 8.85187 8.19458 9.44083 14.6456 17.2989 9.90397 15.0991 8.06326 17.6248 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 7.30288 4.17978 6.85536 9.39546 9.92692 6.49745 4.8419 5.07968 7.16386 12.2768 numMergedOcc 0
14 mol 292 unq 0 iso 0 dist 6.18484 7.24072 4.34283 9.05047 6.40429 3.71231 4.36479 7.29148 9.6898 12.2925 numMergedOcc 0
