0 mol 41 unq 0 iso 0 dist 6.51139 10.8697 6.75602 9.88933 9.88728 7.22319 12.162 10.3589 9.75377 7.09336 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 9.27044 12.456 7.58027 6.73631 9.8821 11.6826 8.98208 3.73929 4.34694 8.80003 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 8.98208 12.456 4.34694 6.73631 8.80003 11.6826 9.27044 3.73929 7.58027 9.8821 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 8.73093 12.3943 7.48556 12.2641 8.61566 10.5152 9.1622 8.96403 9.47045 16.202 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 8.73093 12.3943 7.48556 12.2641 8.61566 10.5152 12.2532 7.99821 8.68218 16.023 numMergedOcc 0
5 mol 73 unq 4 iso 0 dist 8.73093 12.3943 7.48556 5.3163 5.02942 9.39279 9.1622 8.96403 9.47045 10.3625 numMergedOcc 0
6 mol 73 unq 5 iso 0 dist 8.73093 12.3943 7.48556 5.3163 5.02942 9.39279 12.2532 7.99821 8.68218 11.5646 numMergedOcc 0
7 mol 73 unq 6 iso 0 dist 8.02104 9.57143 7.48556 11.4792 8.61566 10.5152 7.59013 8.96403 9.47045 16.202 numMergedOcc 0
8 mol 73 unq 7 iso 0 dist 8.02104 9.57143 7.48556 11.4792 8.61566 10.5152 10.8016 7.99821 8.68218 16.023 numMergedOcc 0
9 mol 73 unq 8 iso 0 dist 8.02104 9.57143 7.48556 5.18759 5.02942 9.39279 7.59013 8.96403 9.47045 10.3625 numMergedOcc 0
10 mol 73 unq 9 iso 0 dist 8.02104 9.57143 7.48556 5.18759 5.02942 9.39279 10.8016 7.99821 8.68218 11.5646 numMergedOcc 0
11 mol 159 unq 0 iso 0 dist 8.20121 10.242 6.86212 7.38933 7.85744 4.72814 16.6101 9.76045 9.54337 11.9271 numMergedOcc 0
12 mol 159 unq 1 iso 0 dist 8.20121 10.242 6.86212 7.38933 7.85744 4.72814 7.52779 4.82545 9.9368 10.541 numMergedOcc 0
13 mol 159 unq 2 iso 0 dist 7.52779 10.242 9.9368 7.2995 7.67418 13.464 16.6101 14.3749 9.54337 20.8174 numMergedOcc 0
14 mol 159 unq 3 iso 0 dist 7.52779 10.242 9.9368 7.2995 7.67418 13.464 8.20121 4.82545 6.86212 11.4186 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 6.36789 12.6035 6.72718 10.9895 8.11956 11.4764 15.9248 10.4327 8.72949 14.6118 numMergedOcc 0
16 mol 187 unq 0 iso 0 dist 7.87608 8.91643 8.0501 5.9319 8.38922 4.8196 13.7054 11.6883 5.58167 10.2904 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 9.78743 13.2525 6.2016 15.5077 5.90008 7.71442 11.7278 6.63296 8.3453 10.1483 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 7.3055 6.1113 6.57444 16.1506 9.96942 16.3701 11.9279 5.77131 7.9555 11.5681 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.3799 9.82863 13.3487 12.2535 7.06161 8.40726 13.7115 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.3799 9.82863 13.3487 12.2535 7.06161 8.40726 13.7115 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.3799 9.82863 13.3487 12.2535 7.06161 8.40726 13.7115 numMergedOcc 0
