0 mol 56 unq 0 iso 0 dist 9.10096 11.5552 6.77886 12.9576 10.5332 9.03564 numMergedOcc 0
1 mol 60 unq 0 iso 0 dist 8.54955 9.35097 7.55695 12.5238 5.71764 8.4312 numMergedOcc 0
2 mol 60 unq 1 iso 0 dist 8.54955 9.8648 8.82176 16.3984 12.9345 9.95132 numMergedOcc 0
3 mol 60 unq 2 iso 0 dist 8.54955 9.8648 8.82176 12.5238 5.71764 7.48086 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 9.70095 5.06206 7.12017 11.6594 13.4027 7.82475 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 9.70095 5.06206 7.12017 8.29463 12.068 5.35782 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.92412 4.37081 6.69515 11.746 5.25982 8.07097 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 6.97579 10.5394 6.69515 4.54218 5.25982 8.07097 numMergedOcc 0
8 mol 178 unq 0 iso 0 dist 8.56251 4.51874 4.92088 10.6504 7.79894 9.11204 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 9.67802 18.5326 9.83476 15.9307 6.38897 7.2793 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 9.67802 18.5326 9.83476 18.1979 8.93258 9.51091 numMergedOcc 0
11 mol 186 unq 2 iso 0 dist 9.67802 18.5326 9.83476 18.2154 11.924 7.85184 numMergedOcc 0
12 mol 186 unq 3 iso 0 dist 9.18314 7.37734 9.83476 11.3685 6.38897 7.2793 numMergedOcc 0
13 mol 186 unq 4 iso 0 dist 9.18314 7.37734 9.83476 14.4839 8.93258 9.51091 numMergedOcc 0
14 mol 186 unq 5 iso 0 dist 9.18314 7.37734 9.83476 7.81696 11.924 7.85184 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 9.96728 7.24106 6.60567 12.7263 9.48862 7.41662 numMergedOcc 0
16 mol 195 unq 1 iso 0 dist 9.96728 12.7239 7.62942 18.4962 8.89297 9.03441 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 7.84953 6.66456 6.29367 12.0371 6.57708 8.75536 numMergedOcc 0
18 mol 218 unq 1 iso 0 dist 7.84953 5.09263 5.76954 12.0371 6.57708 7.33709 numMergedOcc 0
19 mol 218 unq 2 iso 0 dist 7.84953 10.1782 9.20961 12.0371 6.57708 6.67404 numMergedOcc 0
20 mol 218 unq 3 iso 0 dist 4.57726 6.66456 8.86175 12.0371 13.4147 8.75536 numMergedOcc 0
21 mol 218 unq 4 iso 0 dist 4.57726 5.09263 6.29511 12.0371 13.4147 7.33709 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 7.10883 6.7444 6.6561 7.9002 6.35462 6.50998 numMergedOcc 0
23 mol 225 unq 1 iso 0 dist 7.10883 6.7444 6.6561 12.539 5.94765 9.09424 numMergedOcc 0
24 mol 225 unq 2 iso 0 dist 7.10883 6.7444 6.6561 13.4564 11.2847 8.14831 numMergedOcc 0
25 mol 234 unq 0 iso 0 dist 8.10427 9.25445 7.5366 15.858 11.0592 7.81215 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 8.24118 12.8163 6.4398 13.9956 6.22195 8.82351 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 8.24118 5.88384 7.32982 15.5159 13.0611 9.72188 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 9.08573 5.37535 5.64181 12.9409 6.94907 9.08509 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 9.08573 4.14233 7.61393 12.7034 9.9447 9.06592 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 9.70241 4.627 6.57903 10.8958 14.6871 9.57499 numMergedOcc 0
