0 mol 1 unq 0 iso 0 dist 8.61411 5.65716 10.3064 11.1504 17.4071 7.73435 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.61411 5.65716 10.3064 7.10269 14.8414 5.71995 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 5.4424 9.44958 6.67016 12.1708 13.2635 9.10587 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.78545 6.53468 5.32605 12.2874 7.99116 8.58543 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 9.78545 8.78859 7.129 12.2874 7.99116 8.99433 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 5.68726 6.53468 5.9876 12.2874 7.95383 8.58543 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 5.68726 8.78859 3.69759 12.2874 7.95383 8.99433 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 9.97998 5.90954 5.32605 7.81776 7.99116 8.58543 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 7.46882 5.90954 5.9876 7.81776 7.95383 8.58543 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 7.62629 8.42713 13.6486 8.02579 15.0976 5.51624 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 7.62629 8.42713 13.6486 12.3147 14.4125 7.8674 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 5.82034 6.4752 9.78167 6.96543 11.4269 9.23528 numMergedOcc 0
12 mol 159 unq 0 iso 0 dist 9.129 9.91132 14.2067 8.14398 16.0502 8.99983 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 9.51731 8.48559 5.16577 5.61836 8.16601 8.53374 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 9.48142 9.3832 13.5919 16.5085 18.7214 7.3546 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 7.42783 7.63142 11.43 11.9939 17.4362 9.83236 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 6.2441 5.72444 5.18278 5.77167 11.6289 8.93185 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 6.2441 5.72444 5.18278 7.54799 11.6935 8.22792 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 6.71398 9.77502 6.09244 14.9983 13.9106 9.81305 numMergedOcc 0
19 mol 235 unq 1 iso 0 dist 6.71398 9.77502 6.09244 9.81171 10.6449 6.89118 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 8.51287 8.15795 12.4299 4.88527 12.4515 6.47194 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 9.8799 8.28871 14.6311 5.7394 9.66538 5.74568 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 8.82869 9.2542 6.17439 12.0758 11.3539 7.41079 numMergedOcc 0
