0 mol 41 unq 0 iso 0 dist 6.42931 8.28673 10.2887 12.5752 9.18836 13.7632 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 6.42931 8.28673 10.2887 8.68242 6.07294 15.2506 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.66272 8.36915 4.8908 10.7098 8.68989 13.0397 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.66272 6.01454 5.82846 10.7098 8.68989 6.99001 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 8.66272 8.28883 13.2371 12.4205 6.42242 14.8168 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 5.24823 7.57822 8.47667 7.38666 9.68619 11.7527 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 8.64438 8.24549 10.9345 5.00632 6.67326 10.0649 numMergedOcc 0
7 mol 165 unq 0 iso 0 dist 7.74717 8.2197 9.78341 10.5057 5.79029 9.85755 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 9.72342 8.78709 6.36904 4.38798 6.03403 5.67112 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 4.47148 9.08767 5.36423 10.7135 9.2802 12.2297 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 4.47148 9.08767 5.36423 8.30089 7.2843 11.8551 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 6.45234 7.35148 9.97963 5.45485 9.33514 12.2602 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 7.16899 7.41298 4.76856 3.86604 9.6427 8.43762 numMergedOcc 0
13 mol 241 unq 1 iso 0 dist 7.16899 9.99337 11.0792 3.86604 9.6427 9.39754 numMergedOcc 0
14 mol 241 unq 2 iso 0 dist 9.27693 7.41298 5.37459 3.86604 7.82708 8.43762 numMergedOcc 0
15 mol 241 unq 3 iso 0 dist 9.27693 9.99337 5.02153 3.86604 7.82708 9.39754 numMergedOcc 0
16 mol 254 unq 0 iso 0 dist 9.62779 7.53352 9.73538 8.60531 7.28781 10.6914 numMergedOcc 0
17 mol 254 unq 1 iso 0 dist 9.62779 7.80793 8.88569 8.60531 7.28781 12.7992 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 7.06381 9.98985 9.69939 10.2995 5.94449 6.12347 numMergedOcc 0
19 mol 279 unq 1 iso 0 dist 7.06381 9.98985 9.69939 5.10287 8.61452 8.79637 numMergedOcc 0
20 mol 279 unq 2 iso 0 dist 7.06381 9.98985 9.69939 6.69582 7.66302 14.9954 numMergedOcc 0
21 mol 279 unq 3 iso 0 dist 7.06381 7.22295 12.0301 10.2995 5.94449 12.5966 numMergedOcc 0
22 mol 279 unq 4 iso 0 dist 7.06381 7.22295 12.0301 5.10287 8.61452 8.88458 numMergedOcc 0
23 mol 279 unq 5 iso 0 dist 7.06381 7.22295 12.0301 6.69582 7.66302 12.4413 numMergedOcc 0
