0 mol 1 unq 0 iso 0 dist 8.61411 5.65716 10.3064 4.36042 12.1303 8.26708 11.1504 17.4071 7.73435 10.5521 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.61411 5.65716 10.3064 4.36042 12.1303 8.26708 7.10269 14.8414 5.71995 7.15595 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 8.61411 5.65716 10.3064 6.44928 11.5768 6.09918 11.1504 17.4071 7.73435 7.4817 numMergedOcc 0
3 mol 1 unq 3 iso 0 dist 8.61411 5.65716 10.3064 6.44928 11.5768 6.09918 7.10269 14.8414 5.71995 7.63941 numMergedOcc 0
4 mol 13 unq 0 iso 0 dist 5.4424 9.44958 6.67016 11.3605 7.97656 5.78148 12.1708 13.2635 9.10587 10.9884 numMergedOcc 0
5 mol 13 unq 1 iso 0 dist 5.4424 9.44958 6.67016 13.8587 11.8686 6.26071 12.1708 13.2635 9.10587 7.39275 numMergedOcc 0
6 mol 13 unq 2 iso 0 dist 5.4424 9.44958 6.67016 16.4369 14.9969 8.43325 12.1708 13.2635 9.10587 7.82977 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 9.78545 6.53468 5.32605 14.2026 9.58544 8.03303 12.2874 7.99116 8.58543 8.92736 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 5.68726 6.53468 5.9876 14.2026 12.6321 8.03303 12.2874 7.95383 8.58543 8.92736 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 9.97998 5.90954 5.32605 9.27925 9.58544 8.03303 7.81776 7.99116 8.58543 8.92736 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 7.46882 5.90954 5.9876 9.27925 12.6321 8.03303 7.81776 7.95383 8.58543 8.92736 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 7.62629 8.42713 13.6486 17.674 23.2783 9.81831 8.02579 15.0976 5.51624 11.6865 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 7.62629 8.42713 13.6486 17.674 23.2783 9.81831 12.3147 14.4125 7.8674 12.2598 numMergedOcc 0
13 mol 93 unq 2 iso 0 dist 7.62629 8.42713 13.6486 15.232 22.0388 9.12858 8.02579 15.0976 5.51624 7.64463 numMergedOcc 0
14 mol 93 unq 3 iso 0 dist 7.62629 8.42713 13.6486 15.232 22.0388 9.12858 12.3147 14.4125 7.8674 14.8533 numMergedOcc 0
15 mol 93 unq 4 iso 0 dist 7.62629 8.42713 13.6486 12.5871 19.4908 9.4523 8.02579 15.0976 5.51624 8.29171 numMergedOcc 0
16 mol 93 unq 5 iso 0 dist 7.62629 8.42713 13.6486 12.5871 19.4908 9.4523 12.3147 14.4125 7.8674 12.7936 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 5.82034 6.4752 9.78167 8.95179 14.0332 5.49226 6.96543 11.4269 9.23528 9.02993 numMergedOcc 0
18 mol 147 unq 1 iso 0 dist 5.82034 6.4752 9.78167 10.5583 13.5686 6.28351 6.96543 11.4269 9.23528 14.4247 numMergedOcc 0
19 mol 162 unq 0 iso 0 dist 9.51731 8.48559 5.16577 6.46702 9.82249 6.20182 5.61836 8.16601 8.53374 6.69868 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 6.71398 9.77502 6.09244 13.1002 9.71281 6.39158 14.9983 13.9106 9.81305 5.72331 numMergedOcc 0
21 mol 235 unq 1 iso 0 dist 6.71398 9.77502 6.09244 13.1002 9.71281 6.39158 9.81171 10.6449 6.89118 8.33772 numMergedOcc 0
22 mol 235 unq 2 iso 0 dist 6.71398 9.77502 6.09244 6.64857 9.2433 7.75722 14.9983 13.9106 9.81305 12.6437 numMergedOcc 0
23 mol 235 unq 3 iso 0 dist 6.71398 9.77502 6.09244 6.64857 9.2433 7.75722 9.81171 10.6449 6.89118 5.70265 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 8.51287 8.15795 12.4299 12.227 19.5408 9.53063 4.88527 12.4515 6.47194 7.42673 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 9.8799 8.28871 14.6311 11.5671 15.9893 6.04162 5.7394 9.66538 5.74568 6.84156 numMergedOcc 0
26 mol 264 unq 1 iso 0 dist 9.8799 8.28871 14.6311 13.8765 17.8973 6.14323 5.7394 9.66538 5.74568 9.37297 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 8.82869 9.2542 6.17439 11.198 13.3489 7.91611 12.0758 11.3539 7.41079 6.21267 numMergedOcc 0
