0 mol 62 unq 0 iso 0 dist 4.85282 6.02731 7.46975 7.29999 8.84323 6.04903 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 5.77675 5.86118 4.31746 8.6915 5.70192 9.0008 numMergedOcc 0
2 mol 67 unq 1 iso 0 dist 5.77675 5.86118 4.31746 5.987 9.65433 9.77887 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 8.8763 6.37224 4.1431 10.1316 8.42487 9.07734 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 6.8456 7.27601 3.88006 16.3901 12.8915 9.83981 numMergedOcc 0
5 mol 114 unq 1 iso 0 dist 6.8456 7.27601 3.88006 11.226 9.63389 6.13559 numMergedOcc 0
6 mol 114 unq 2 iso 0 dist 6.8456 7.27601 3.88006 7.41949 6.96057 6.51395 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 9.20442 9.38149 8.92172 6.31583 9.01192 7.75012 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 6.34149 8.21272 5.21047 13.0233 11.7419 6.87262 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 8.63279 8.21272 5.73901 13.0233 12.5162 6.87262 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 8.55237 6.03852 10.0548 5.29975 11.5296 5.26989 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 8.55237 6.26056 4.12065 5.29975 11.5296 7.76442 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 7.80661 8.97069 10.0548 6.38237 11.5296 5.26989 numMergedOcc 0
13 mol 141 unq 3 iso 0 dist 7.80661 5.7251 4.12065 6.38237 11.5296 7.76442 numMergedOcc 0
14 mol 168 unq 0 iso 0 dist 8.80094 8.80059 16.5533 8.27116 15.1243 7.60254 numMergedOcc 0
15 mol 168 unq 1 iso 0 dist 9.03681 8.80059 9.91815 8.27116 12.018 7.60254 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 8.91036 7.3879 7.6477 6.76195 9.56248 8.41245 numMergedOcc 0
17 mol 173 unq 1 iso 0 dist 8.91036 9.70728 5.04427 6.76195 9.56248 6.64779 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 5.39622 8.28099 5.18732 9.25757 9.08641 9.84492 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 8.15743 8.70651 6.36084 14.7996 9.61294 7.17337 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 5.67249 9.45787 11.1213 5.04225 10.1461 7.43663 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 5.67249 9.45787 11.1213 12.3321 15.1226 7.94068 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 6.5095 7.24253 10.2558 5.32118 11.7029 7.12785 numMergedOcc 0
23 mol 243 unq 1 iso 0 dist 6.5095 7.24253 10.2558 11.4546 16.1722 6.66959 numMergedOcc 0
24 mol 243 unq 2 iso 0 dist 5.1766 7.24253 3.87679 5.32118 7.77265 7.12785 numMergedOcc 0
25 mol 243 unq 3 iso 0 dist 5.1766 7.24253 3.87679 11.4546 9.65322 6.66959 numMergedOcc 0
