0 mol 55 unq 0 iso 0 dist 9.95691 7.66306 4.97078 10.957 9.78051 6.13181 numMergedOcc 0
1 mol 90 unq 0 iso 0 dist 4.75701 7.63894 8.89062 6.23206 10.684 7.51138 numMergedOcc 0
2 mol 90 unq 1 iso 0 dist 4.75701 7.63894 8.89062 12.753 16.047 9.86843 numMergedOcc 0
3 mol 90 unq 2 iso 0 dist 4.75701 7.63894 8.89062 12.3706 15.0774 6.86146 numMergedOcc 0
4 mol 90 unq 3 iso 0 dist 4.75701 7.63894 8.89062 12.9414 13.5917 8.83296 numMergedOcc 0
5 mol 90 unq 4 iso 0 dist 9.89618 6.17315 8.89062 6.59471 10.684 7.51138 numMergedOcc 0
6 mol 90 unq 5 iso 0 dist 9.89618 6.17315 8.89062 12.5885 16.047 9.86843 numMergedOcc 0
7 mol 90 unq 6 iso 0 dist 9.89618 6.17315 8.89062 9.78924 15.0774 6.86146 numMergedOcc 0
8 mol 90 unq 7 iso 0 dist 9.89618 6.17315 8.89062 14.6058 13.5917 8.83296 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 9.10877 8.21739 8.29171 3.74136 9.4523 5.51624 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 9.10877 4.78377 12.7936 3.74136 9.4523 7.8674 numMergedOcc 0
11 mol 111 unq 0 iso 0 dist 7.42431 5.61533 6.39411 7.46433 13.6815 8.77841 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 9.96969 7.03509 8.83173 5.57363 10.0788 7.63127 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 7.4653 7.01483 9.02993 5.88056 5.49226 9.23528 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 7.95564 7.01483 6.07098 5.88056 10.8047 9.23528 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 6.32876 6.96911 10.5941 6.03398 10.2139 4.9941 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 9.25604 6.96911 7.7635 6.03398 11.0871 4.9941 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 8.8508 9.67802 10.6098 14.8027 17.496 8.12349 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 6.51823 8.24118 12.6097 15.4849 18.4055 9.89583 numMergedOcc 0
19 mol 252 unq 0 iso 0 dist 7.58175 9.27529 9.58111 10.4532 15.6179 8.55481 numMergedOcc 0
