0 mol 8 unq 0 iso 0 dist 7.77271 7.0822 6.26865 5.41248 8.93691 8.79697 numMergedOcc 0
1 mol 39 unq 0 iso 0 dist 7.54441 5.92759 8.43814 13.5599 8.70893 9.83017 numMergedOcc 0
2 mol 39 unq 1 iso 0 dist 7.54441 5.92759 8.43814 8.76925 5.93243 5.1736 numMergedOcc 0
3 mol 39 unq 2 iso 0 dist 9.84326 5.92759 8.16689 13.5599 6.82468 9.83017 numMergedOcc 0
4 mol 39 unq 3 iso 0 dist 9.84326 5.92759 8.16689 8.76925 5.03446 5.1736 numMergedOcc 0
5 mol 105 unq 0 iso 0 dist 6.13301 7.9126 6.52726 9.96269 4.27067 6.88308 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 7.81181 11.5609 8.39249 13.9107 10.7702 6.06039 numMergedOcc 0
7 mol 175 unq 0 iso 0 dist 9.21278 3.81023 6.74517 10.2915 4.43167 7.92974 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 9.30874 10.168 8.20656 13.6437 6.72205 5.89833 numMergedOcc 0
9 mol 181 unq 1 iso 0 dist 5.54873 10.168 9.40622 13.6437 10.7557 5.89833 numMergedOcc 0
10 mol 193 unq 0 iso 0 dist 9.42057 6.8779 6.33838 12.0932 5.12102 6.00381 numMergedOcc 0
11 mol 224 unq 0 iso 0 dist 6.04427 5.56344 4.55996 5.07376 4.60179 7.26162 numMergedOcc 0
12 mol 224 unq 1 iso 0 dist 6.33797 7.21175 4.55996 10.8531 4.60179 7.26162 numMergedOcc 0
13 mol 224 unq 2 iso 0 dist 9.97425 4.92261 8.89778 12.1661 4.76056 9.89345 numMergedOcc 0
14 mol 224 unq 3 iso 0 dist 8.39753 6.78064 8.89778 8.96263 4.76056 9.89345 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.90344 13.4787 6.00721 9.51579 5.2539 9.61559 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 9.10967 7.1782 7.25543 7.80073 4.81796 6.98781 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 7.83632 5.88198 7.25543 10.2683 4.81796 6.98781 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 9.418 10.5554 7.4363 13.2154 3.83813 9.60653 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 8.10823 4.95598 7.4363 10.7197 3.83813 9.60653 numMergedOcc 0
