0 mol 64 unq 0 iso 0 dist 9.5663 12.6498 6.08228 12.0987 5.66803 5.88036 5.40109 9.23947 11.3115 8.95689 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 9.23755 12.5791 8.4438 10.3397 7.58027 9.96367 15.0981 6.82707 7.94629 12.5165 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.23755 12.5791 8.4438 8.31117 4.34694 9.65371 15.0981 6.82707 7.94629 10.5011 numMergedOcc 0
3 mol 147 unq 0 iso 0 dist 6.85063 6.69773 9.13646 5.38327 5.32865 4.61905 4.11976 8.40219 7.24469 5.30729 numMergedOcc 0
4 mol 165 unq 0 iso 0 dist 7.22838 14.3514 9.59989 5.97663 6.85551 9.94274 6.77685 5.79029 9.33914 6.57529 numMergedOcc 0
5 mol 220 unq 0 iso 0 dist 5.60195 8.66923 7.86207 5.84371 9.89039 9.09963 7.03806 7.46122 4.39102 9.36068 numMergedOcc 0
6 mol 220 unq 1 iso 0 dist 5.60195 8.66923 7.86207 12.9073 8.57174 14.3078 7.03806 7.46122 4.39102 15.6078 numMergedOcc 0
7 mol 220 unq 2 iso 0 dist 7.87359 5.3178 7.86207 4.72275 9.89039 9.09963 4.69654 7.46122 4.39102 9.36068 numMergedOcc 0
8 mol 220 unq 3 iso 0 dist 7.87359 5.3178 7.86207 15.2936 8.57174 14.3078 4.69654 7.46122 4.39102 15.6078 numMergedOcc 0
9 mol 226 unq 0 iso 0 dist 6.3687 12.3798 7.20862 4.52889 8.74399 12.3908 6.62409 5.3747 8.58832 7.20864 numMergedOcc 0
10 mol 236 unq 0 iso 0 dist 5.46484 8.95567 7.6402 5.81446 7.74348 13.5224 5.69026 8.88405 8.43621 8.64384 numMergedOcc 0
11 mol 236 unq 1 iso 0 dist 5.46484 8.95567 7.6402 5.81446 7.74348 13.5224 8.22446 7.13854 6.96377 9.7977 numMergedOcc 0
12 mol 236 unq 2 iso 0 dist 8.80671 5.98568 7.6402 14.8289 7.74348 13.5224 11.4601 8.88405 8.43621 8.64384 numMergedOcc 0
13 mol 236 unq 3 iso 0 dist 8.80671 5.98568 7.6402 14.8289 7.74348 13.5224 6.4298 7.13854 6.96377 9.7977 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 8.49961 13.8894 8.34832 13.284 8.48545 14.2079 9.7952 6.91534 15.1473 9.08479 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 8.49961 13.8894 8.34832 13.284 8.48545 14.2079 10.1967 8.67704 16.5164 5.88166 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 9.66298 17.0555 9.70222 6.94755 4.85199 10.6318 11.7392 6.45102 5.48108 5.52134 numMergedOcc 0
17 mol 261 unq 1 iso 0 dist 9.66298 17.0555 9.70222 17.3605 9.72159 4.97878 11.7392 6.45102 5.48108 7.0673 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 9.46926 11.7148 8.61786 4.95934 8.8646 9.94141 15.6565 9.54381 5.4894 14.5123 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 9.46926 7.8329 8.42706 4.95934 8.8646 3.93133 15.6565 9.54381 15.3099 14.5123 numMergedOcc 0
