0 mol 1 unq 0 iso 0 dist 9.72202 9.39338 8.56884 10.8122 4.50502 5.96833 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 6.82187 4.96682 9.29358 8.83891 6.91314 9.51568 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 6.12361 10.6118 8.82012 10.3597 5.56139 5.84066 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.80897 11.1917 6.73162 12.5406 7.11305 9.96121 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 8.37225 6.0365 6.73162 12.0533 7.11305 9.96121 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.77218 13.1819 8.19682 22.3892 15.4159 9.4866 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 7.46657 6.14439 6.21982 6.55112 5.31985 9.4866 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 9.41191 7.32599 5.87358 12.232 6.35679 8.38791 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 7.9258 10.8105 7.76729 12.5457 6.63111 8.0168 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.47554 6.61857 7.92688 15.0791 14.8533 9.10003 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 8.57712 6.6805 7.39644 8.99128 7.10286 5.36254 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 7.7544 5.20775 4.93785 13.6955 6.8757 9.09234 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 7.7544 5.20775 4.93785 5.97971 5.71898 6.76746 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 7.7544 5.20775 4.93785 9.30874 5.83796 8.92098 numMergedOcc 0
14 mol 182 unq 0 iso 0 dist 9.06702 10.9586 6.73313 9.82379 4.88992 5.73635 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 7.04524 10.9358 8.36117 9.20541 6.04871 5.87439 numMergedOcc 0
16 mol 195 unq 1 iso 0 dist 7.04524 7.60158 6.77578 9.20541 6.04871 8.18059 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 8.27093 6.92493 8.17891 5.77762 4.1511 7.79951 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 9.02226 9.72888 9.62609 16.9798 14.6485 9.8009 numMergedOcc 0
19 mol 227 unq 2 iso 0 dist 9.02226 6.92493 6.95902 5.77762 4.69247 7.79951 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 5.46736 10.024 6.25105 10.8796 5.53885 7.36208 numMergedOcc 0
