0 mol 18 unq 0 iso 0 dist 8.60149 5.816 6.19657 13.5046 10.1168 9.1397 8.93025 5.61403 8.09187 8.70343 numMergedOcc 0
1 mol 36 unq 0 iso 0 dist 8.47497 8.02028 9.96441 12.2454 6.66097 8.41542 11.864 10.8132 7.23219 7.87445 numMergedOcc 0
2 mol 102 unq 0 iso 0 dist 8.63522 6.04036 9.49592 9.0361 10.2218 5.54256 6.793 7.99081 7.68537 5.498 numMergedOcc 0
3 mol 102 unq 1 iso 0 dist 5.43401 6.04036 5.88034 9.0361 8.17186 5.54256 6.793 6.83631 7.68537 5.498 numMergedOcc 0
4 mol 152 unq 0 iso 0 dist 7.53834 11.2878 8.78397 16.3905 13.1754 6.79114 15.8837 9.92336 9.70169 7.86749 numMergedOcc 0
5 mol 197 unq 0 iso 0 dist 8.51118 11.048 7.06868 16.0074 8.69245 9.23086 14.8934 10.1284 9.77656 5.2908 numMergedOcc 0
6 mol 197 unq 1 iso 0 dist 8.51118 11.048 7.06868 13.1397 4.6678 8.37086 14.8934 10.1284 9.77656 10.5397 numMergedOcc 0
7 mol 259 unq 0 iso 0 dist 8.91916 15.0418 8.75224 14.9752 13.3027 8.25897 15.8134 11.3446 5.23503 4.99891 numMergedOcc 0
8 mol 259 unq 1 iso 0 dist 8.91916 15.0418 8.75224 14.9752 13.3027 8.25897 12.0867 11.1732 9.61028 5.32839 numMergedOcc 0
9 mol 277 unq 0 iso 0 dist 6.23539 13.6904 9.48076 17.7394 12.7618 5.72327 14.6021 8.46112 8.13595 8.91002 numMergedOcc 0
10 mol 277 unq 1 iso 0 dist 6.23539 13.6904 9.48076 18.919 13.8339 5.81301 14.6021 8.46112 8.13595 8.34559 numMergedOcc 0
11 mol 277 unq 2 iso 0 dist 6.23539 13.6904 9.48076 21.7945 16.0093 9.81201 14.6021 8.46112 8.13595 8.76212 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 8.04003 4.57745 9.78064 9.22306 5.64519 9.18744 9.11967 5.89971 7.77225 4.62998 numMergedOcc 0
13 mol 288 unq 0 iso 0 dist 8.04003 4.57745 9.78064 9.22306 5.64519 9.18744 9.11967 5.89971 7.77225 4.62998 numMergedOcc 0
14 mol 289 unq 0 iso 0 dist 8.04003 4.57745 9.78064 9.22306 5.64519 9.18744 9.11967 5.89971 7.77225 4.62998 numMergedOcc 0
