0 mol 70 unq 0 iso 0 dist 8.30653 9.33262 14.4239 9.87737 5.78087 16.6291 9.9009 17.8699 9.31969 19.6057 numMergedOcc 0
1 mol 70 unq 1 iso 0 dist 8.30653 9.33262 14.4239 9.87737 5.78087 16.6291 9.66495 16.1199 6.54023 19.1293 numMergedOcc 0
2 mol 70 unq 2 iso 0 dist 8.30653 9.33262 14.4239 6.7303 6.10128 13.2887 9.9009 17.8699 9.31969 16.1396 numMergedOcc 0
3 mol 70 unq 3 iso 0 dist 8.30653 9.33262 14.4239 6.7303 6.10128 13.2887 9.66495 16.1199 6.54023 15.8739 numMergedOcc 0
4 mol 70 unq 4 iso 0 dist 6.91739 9.33262 10.4473 9.87737 6.64078 16.6291 9.9009 15.2906 9.31969 19.6057 numMergedOcc 0
5 mol 70 unq 5 iso 0 dist 6.91739 9.33262 10.4473 9.87737 6.64078 16.6291 9.66495 14.3002 6.54023 19.1293 numMergedOcc 0
6 mol 70 unq 6 iso 0 dist 6.91739 9.33262 10.4473 6.7303 3.80229 13.2887 9.9009 15.2906 9.31969 16.1396 numMergedOcc 0
7 mol 70 unq 7 iso 0 dist 6.91739 9.33262 10.4473 6.7303 3.80229 13.2887 9.66495 14.3002 6.54023 15.8739 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 8.86938 5.9819 8.56707 6.79584 4.69658 4.25001 4.9102 7.71338 6.43433 6.87434 numMergedOcc 0
9 mol 112 unq 1 iso 0 dist 8.86938 5.9819 8.56707 6.79584 4.69658 4.25001 6.84034 12.603 9.92283 11.5809 numMergedOcc 0
10 mol 112 unq 2 iso 0 dist 7.42474 5.9819 12.6695 6.79584 13.1881 4.25001 4.9102 11.8312 6.43433 6.87434 numMergedOcc 0
11 mol 112 unq 3 iso 0 dist 7.42474 5.9819 12.6695 6.79584 13.1881 4.25001 6.84034 11.438 9.92283 11.5809 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 6.71293 5.93793 9.70339 6.67979 9.79481 5.46636 8.07661 14.4958 8.97264 11.4882 numMergedOcc 0
13 mol 124 unq 1 iso 0 dist 6.71293 5.93793 9.70339 6.67979 9.79481 5.46636 8.29712 14.8242 8.80896 8.57739 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.52413 6.59729 10.3944 8.86574 4.04122 9.42515 10.2733 16.6323 6.72641 14.6993 numMergedOcc 0
15 mol 189 unq 0 iso 0 dist 8.59972 9.5853 5.4905 8.49359 4.28607 8.73039 5.56399 10.4329 8.56355 12.2245 numMergedOcc 0
16 mol 230 unq 0 iso 0 dist 6.03738 6.47064 10.753 8.32382 4.65404 12.1428 10.7614 16.2199 9.09271 18.9657 numMergedOcc 0
17 mol 230 unq 1 iso 0 dist 6.03738 6.47064 10.753 8.32382 4.65404 12.1428 11.777 17.3341 7.44838 18.9659 numMergedOcc 0
18 mol 248 unq 0 iso 0 dist 7.40475 9.08064 5.99459 5.76741 6.19721 4.91893 7.63032 7.69895 6.17052 7.79063 numMergedOcc 0
19 mol 248 unq 1 iso 0 dist 7.40475 9.08064 5.99459 5.76741 6.19721 4.91893 6.42334 7.21521 9.77666 9.64778 numMergedOcc 0
20 mol 261 unq 0 iso 0 dist 9.80409 5.67349 6.04016 8.55479 11.4108 11.1232 4.63237 9.14619 5.26434 12.3855 numMergedOcc 0
21 mol 261 unq 1 iso 0 dist 9.80409 5.67349 6.04016 8.55479 11.4108 11.1232 6.39263 8.45658 8.60026 8.24356 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 9.07206 9.91954 12.6928 6.26593 13.3122 8.89888 15.213 18.4752 7.52281 14.7806 numMergedOcc 0
23 mol 264 unq 1 iso 0 dist 9.07206 9.91954 12.6928 6.26593 13.3122 8.89888 7.50444 10.6405 6.42588 10.4401 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 7.77765 5.78275 12.0308 7.0445 14.5847 4.65086 9.13951 14.9913 7.91611 8.88595 numMergedOcc 0
