0 mol 26 unq 0 iso 0 dist 6.32127 9.47439 8.01238 11.5211 8.35396 13.7149 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 5.0478 6.11985 6.54052 7.50891 6.32568 12.1306 numMergedOcc 0
2 mol 74 unq 0 iso 0 dist 7.14572 12.8582 8.70305 5.34599 9.5543 11.1985 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 7.74952 7.15993 4.86532 13.2459 9.44289 6.21391 numMergedOcc 0
4 mol 91 unq 1 iso 0 dist 8.99674 10.0293 4.86532 12.9125 9.44289 6.21391 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 8.22984 10.3484 6.34031 11.3386 9.18792 11.8965 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 6.6157 8.28108 6.34031 6.5384 9.18792 11.8965 numMergedOcc 0
7 mol 100 unq 2 iso 0 dist 7.37771 6.48142 6.34031 6.26599 9.18792 11.8965 numMergedOcc 0
8 mol 136 unq 0 iso 0 dist 9.2211 7.19078 4.91837 7.65733 7.99739 4.33075 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.80081 11.9052 6.41084 12.9921 7.90709 6.86307 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 9.45931 12.9231 6.93424 13.3971 9.03842 15.8234 numMergedOcc 0
11 mol 141 unq 2 iso 0 dist 6.49728 6.00072 6.93424 12.9921 9.03842 15.8234 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 7.93807 6.25478 9.83216 13.1927 9.32545 10.8143 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 5.11863 11.4233 9.13228 6.17909 9.02161 11.4479 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 5.11863 11.4233 9.13228 9.54933 8.38137 7.88594 numMergedOcc 0
15 mol 184 unq 2 iso 0 dist 5.92785 4.96558 9.13228 6.8573 9.02161 11.4479 numMergedOcc 0
16 mol 184 unq 3 iso 0 dist 5.92785 4.96558 9.13228 5.66314 8.38137 7.88594 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 7.27051 8.2534 7.57117 9.56754 5.47004 4.68101 numMergedOcc 0
18 mol 192 unq 1 iso 0 dist 7.35424 8.2534 9.9312 9.56754 7.36742 4.68101 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 6.74767 4.02994 7.62513 5.80945 8.51608 8.77193 numMergedOcc 0
20 mol 249 unq 0 iso 0 dist 9.68308 9.85936 6.7282 8.81245 6.72501 12.1107 numMergedOcc 0
21 mol 261 unq 0 iso 0 dist 5.83338 6.15322 9.9247 7.35121 9.57431 10.0802 numMergedOcc 0
