0 mol 21 unq 0 iso 0 dist 9.19322 9.83589 13.5541 6.3338 14.2848 9.53277 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.10063 6.77987 6.75063 6.50899 8.9776 8.31631 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 5.31968 5.84349 6.23577 3.82411 7.89306 4.64187 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 5.31968 5.84349 6.23577 4.28598 8.36697 7.95437 numMergedOcc 0
4 mol 33 unq 2 iso 0 dist 9.86405 5.84349 8.05395 3.82411 11.3212 4.64187 numMergedOcc 0
5 mol 33 unq 3 iso 0 dist 9.86405 5.84349 8.05395 4.28598 11.9899 7.95437 numMergedOcc 0
6 mol 37 unq 0 iso 0 dist 8.31005 9.15499 9.56609 3.96491 9.83271 9.59073 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 8.17492 9.6401 5.74753 6.63195 6.89855 8.78414 numMergedOcc 0
8 mol 63 unq 1 iso 0 dist 7.10403 8.53833 5.82517 11.1855 7.85738 8.78414 numMergedOcc 0
9 mol 69 unq 0 iso 0 dist 8.72237 9.77648 9.81292 17.1322 17.4722 9.08745 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 7.78105 8.52697 7.19348 8.47393 11.6139 9.04293 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 6.27877 6.24296 8.08787 3.81285 7.51319 4.29937 numMergedOcc 0
12 mol 85 unq 1 iso 0 dist 6.27877 6.24296 8.08787 6.17121 8.49887 5.37869 numMergedOcc 0
13 mol 85 unq 2 iso 0 dist 6.27877 6.83218 10.4844 3.81285 7.51319 3.65628 numMergedOcc 0
14 mol 85 unq 3 iso 0 dist 6.27877 6.83218 10.4844 6.17121 8.49887 4.05415 numMergedOcc 0
15 mol 91 unq 0 iso 0 dist 8.01351 6.64714 5.09341 9.46631 8.91998 7.71625 numMergedOcc 0
16 mol 91 unq 1 iso 0 dist 8.98201 6.64714 12.2247 9.46631 14.3274 7.71625 numMergedOcc 0
17 mol 91 unq 2 iso 0 dist 6.4026 6.64714 7.1967 9.46631 11.687 7.71625 numMergedOcc 0
18 mol 116 unq 0 iso 0 dist 8.49761 5.93365 8.82571 4.26914 10.6766 7.54274 numMergedOcc 0
19 mol 141 unq 0 iso 0 dist 5.68406 5.24228 4.62155 6.46148 8.12558 5.95801 numMergedOcc 0
20 mol 141 unq 1 iso 0 dist 5.68406 5.24228 4.62155 14.5965 11.5996 9.92715 numMergedOcc 0
21 mol 243 unq 0 iso 0 dist 8.02005 9.49016 11.8086 18.1416 19.9485 9.53137 numMergedOcc 0
22 mol 251 unq 0 iso 0 dist 7.73217 5.85851 5.04918 3.46172 8.15014 7.72528 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 7.86721 8.88095 6.83947 6.15282 10.1115 8.62266 numMergedOcc 0
