0 mol 0 unq 0 iso 0 dist 7.79297 16.4903 9.19007 6.73401 9.67081 16.5238 13.9478 7.02374 7.92928 16.6667 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.20552 6.49868 7.88043 8.16305 7.78327 10.6558 15.12 12.2708 9.55056 18.6994 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.20552 6.49868 7.88043 8.16305 7.78327 10.6558 12.057 6.06176 7.45262 13.2302 numMergedOcc 0
3 mol 7 unq 2 iso 0 dist 9.20552 8.07954 8.80762 8.16305 7.78327 13.5227 15.12 12.2708 7.57354 18.6994 numMergedOcc 0
4 mol 7 unq 3 iso 0 dist 9.20552 8.07954 8.80762 8.16305 7.78327 13.5227 12.057 6.06176 6.96586 13.2302 numMergedOcc 0
5 mol 111 unq 0 iso 0 dist 6.34542 6.40295 7.71107 11.2375 9.06601 12.2445 12.5893 7.59143 9.41723 12.2574 numMergedOcc 0
6 mol 111 unq 1 iso 0 dist 6.34542 6.40295 7.71107 6.87591 5.98809 3.75797 12.5893 7.59143 9.41723 7.75479 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 6.71345 6.51881 6.34525 11.5242 9.93438 13.7162 11.5339 5.31367 8.06525 12.6545 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 5.06555 10.214 8.93905 8.14689 6.42623 9.23272 9.68343 8.94259 8.43028 13.8196 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 5.06555 10.214 8.93905 5.74365 8.95899 14.3708 9.68343 8.94259 8.43028 15.4189 numMergedOcc 0
10 mol 178 unq 0 iso 0 dist 8.04723 5.24118 4.92088 12.3914 4.72821 8.56547 5.85439 5.25267 5.98771 9.8525 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 7.39185 9.67099 6.60567 4.22848 6.59544 11.5264 18.9596 13.6975 9.79691 19.9724 numMergedOcc 0
12 mol 195 unq 1 iso 0 dist 4.78641 9.33058 6.60567 4.65343 6.59544 11.5264 16.5892 13.6975 9.79691 19.9724 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 7.94344 6.27546 8.46327 10.313 9.06459 13.3401 12.3931 10.7373 7.2498 14.5432 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 9.79816 10.5293 8.06216 5.27483 7.84952 9.46108 5.66171 7.47048 9.67381 8.5244 numMergedOcc 0
15 mol 218 unq 1 iso 0 dist 9.79816 10.888 5.76954 5.27483 7.84952 11.2216 14.723 9.68444 6.86795 15.9417 numMergedOcc 0
16 mol 218 unq 2 iso 0 dist 9.79816 10.888 5.76954 5.27483 7.84952 11.2216 5.66171 7.47048 6.61099 8.5244 numMergedOcc 0
17 mol 240 unq 0 iso 0 dist 7.6664 14.1051 9.47583 3.99769 5.77749 10.2659 18.0741 10.7371 8.33853 14.9624 numMergedOcc 0
18 mol 240 unq 1 iso 0 dist 7.6664 14.1051 9.47583 3.99769 5.77749 10.2659 19.423 13.9225 5.66537 15.5469 numMergedOcc 0
