0 mol 28 unq 0 iso 0 dist 5.60121 6.53312 4.98223 5.60162 5.64624 5.9948 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 5.64624 5.9948 4.98223 5.60162 5.60121 6.53312 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.39911 7.55854 6.41876 5.42387 10.256 5.48669 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 9.39911 7.55854 6.41876 8.6475 9.07553 5.78051 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 9.07553 5.78051 6.41876 8.6475 9.39911 7.55854 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 9.07553 5.78051 6.41876 4.81031 10.256 5.48669 numMergedOcc 0
6 mol 65 unq 0 iso 0 dist 8.14002 8.72097 9.09593 13.1791 12.3523 9.19964 numMergedOcc 0
7 mol 144 unq 0 iso 0 dist 9.64843 6.21815 8.63947 8.30972 15.1873 9.87298 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 7.38495 9.69111 5.35061 13.9418 6.75751 9.03681 numMergedOcc 0
9 mol 168 unq 1 iso 0 dist 5.45739 8.80094 4.48341 4.23264 6.9335 8.07126 numMergedOcc 0
10 mol 168 unq 2 iso 0 dist 5.45739 9.03681 13.7826 13.9418 19.374 9.69111 numMergedOcc 0
11 mol 168 unq 3 iso 0 dist 6.75751 8.80094 15.3661 4.23264 8.35883 8.07126 numMergedOcc 0
12 mol 168 unq 4 iso 0 dist 6.75751 9.03681 5.35061 13.9418 7.38495 9.69111 numMergedOcc 0
13 mol 168 unq 5 iso 0 dist 6.9335 8.07126 4.48341 4.23264 5.45739 8.80094 numMergedOcc 0
14 mol 168 unq 6 iso 0 dist 8.35883 8.07126 15.3661 4.23264 6.75751 8.80094 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 6.22076 7.7195 7.58118 7.10314 8.30602 8.30819 numMergedOcc 0
16 mol 171 unq 1 iso 0 dist 8.30602 8.30819 7.58118 7.10314 6.22076 7.7195 numMergedOcc 0
17 mol 176 unq 0 iso 0 dist 6.3518 8.08891 12.148 4.48841 10.5677 6.55106 numMergedOcc 0
18 mol 180 unq 0 iso 0 dist 9.00337 6.33325 11.7404 10.9158 12.8878 8.65601 numMergedOcc 0
19 mol 251 unq 0 iso 0 dist 6.50325 8.3966 5.78162 5.64127 5.26597 5.34851 numMergedOcc 0
20 mol 251 unq 1 iso 0 dist 5.26597 5.34851 5.78162 5.64127 6.50325 8.3966 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 9.11905 8.79012 15.9613 8.62358 14.137 4.76689 numMergedOcc 0
22 mol 260 unq 1 iso 0 dist 7.56352 8.79012 14.4278 8.62358 15.7561 4.76689 numMergedOcc 0
