0 mol 33 unq 0 iso 0 dist 8.41842 7.41772 5.2746 11.8297 7.82815 4.92283 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 8.55004 11.8998 9.42071 7.23303 7.73836 5.9318 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 8.34804 12.6838 6.0478 3.77705 6.44825 9.4319 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 9.34752 10.6499 8.84146 11.6896 8.93181 7.73675 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 8.41858 10.2473 8.84146 3.9434 8.93181 7.73675 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 9.92685 7.19014 4.85559 12.989 9.67398 6.76477 numMergedOcc 0
6 mol 139 unq 0 iso 0 dist 5.77343 4.61769 9.84729 4.37138 7.20542 7.97876 numMergedOcc 0
7 mol 171 unq 0 iso 0 dist 6.20851 5.31547 6.81707 9.12839 9.67711 6.1593 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 8.84813 11.4674 4.0037 5.21212 6.95244 10.7636 numMergedOcc 0
9 mol 173 unq 1 iso 0 dist 8.84813 11.4674 4.0037 11.2286 6.11224 9.14584 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 5.83898 9.4839 5.67811 10.2261 9.77333 7.26749 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 5.83898 10.0038 8.74308 10.2261 9.77333 9.78272 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 8.40718 13.4719 9.42862 12.5259 5.81438 11.0735 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 8.55805 8.04161 8.31564 5.06821 8.63649 5.24307 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 7.47852 7.01029 8.768 11.1052 8.94981 6.35462 numMergedOcc 0
15 mol 225 unq 1 iso 0 dist 7.47852 7.01029 8.768 3.60045 5.90986 5.94765 numMergedOcc 0
16 mol 225 unq 2 iso 0 dist 7.47852 7.01029 8.768 10.6169 7.50697 11.2847 numMergedOcc 0
17 mol 225 unq 3 iso 0 dist 6.22332 11.2993 8.768 13.5289 8.94981 6.35462 numMergedOcc 0
18 mol 225 unq 4 iso 0 dist 6.22332 11.2993 8.768 6.40342 5.90986 5.94765 numMergedOcc 0
19 mol 225 unq 5 iso 0 dist 6.22332 11.2993 8.768 9.92088 7.50697 11.2847 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.33791 10.7175 9.98606 3.79641 8.62843 10.4051 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 8.299 12.3159 8.84798 3.7056 5.61134 8.8725 numMergedOcc 0
