0 mol 7 unq 0 iso 0 dist 8.14952 9.02869 8.4061 4.91115 10.4566 7.11539 9.89388 11.2373 6.44558 6.14469 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 5.9021 6.6051 4.86727 13.5603 14.0611 9.52857 15.1974 14.997 10.1802 5.76024 numMergedOcc 0
2 mol 12 unq 1 iso 0 dist 5.9021 6.6051 4.86727 13.5603 14.0611 9.52857 14.8024 16.4512 11.8349 7.92714 numMergedOcc 0
3 mol 12 unq 2 iso 0 dist 5.9021 6.6051 4.86727 13.5603 14.0611 9.52857 19.2565 17.3012 13.1322 8.47217 numMergedOcc 0
4 mol 12 unq 3 iso 0 dist 8.98466 6.6051 10.763 13.5603 15.4089 9.52857 15.1974 14.2239 10.1802 5.76024 numMergedOcc 0
5 mol 12 unq 4 iso 0 dist 8.98466 6.6051 10.763 13.5603 15.4089 9.52857 14.8024 11.5934 11.8349 7.92714 numMergedOcc 0
6 mol 12 unq 5 iso 0 dist 8.98466 6.6051 10.763 13.5603 15.4089 9.52857 19.2565 20.263 13.1322 8.47217 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 7.38928 9.40644 8.74683 11.0398 14.4137 7.66163 18.3273 19.8924 11.2238 8.29857 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 7.38928 5.35252 5.03338 11.0398 14.4137 9.48288 18.3273 19.8924 15.6905 8.29857 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 7.41952 8.64686 9.57704 8.69896 13.0659 5.33546 9.21479 12.295 9.40625 9.78384 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 5.78962 8.91354 7.47242 12.671 12.6261 7.12701 6.93893 9.0185 5.06999 8.66165 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 8.34427 9.52061 7.12885 5.9261 9.86237 6.52844 7.32407 4.68204 7.72162 9.73158 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 8.34427 9.52061 7.12885 5.9261 9.86237 6.52844 6.48695 9.09658 7.95267 7.59327 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.47689 9.40718 5.15002 14.1039 10.9743 9.2933 14.0071 9.12123 5.10499 7.22883 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 7.30965 6.2016 5.21255 13.2917 12.7509 8.14859 20.3493 17.3011 14.4054 8.26288 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 7.30965 6.2016 5.21255 13.2917 12.7509 8.14859 15.2501 12.9926 9.72372 6.60053 numMergedOcc 0
16 mol 192 unq 2 iso 0 dist 7.30965 6.2016 5.21255 10.3343 9.99783 5.62421 15.2501 12.9926 9.72372 9.36796 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 7.35148 6.39087 11.4142 5.45485 12.2602 5.75839 14.0933 19.0318 9.70769 9.73541 numMergedOcc 0
18 mol 249 unq 0 iso 0 dist 7.58833 8.00386 10.9665 11.2425 15.2001 9.58168 14.5069 18.4192 9.38829 5.9627 numMergedOcc 0
19 mol 249 unq 1 iso 0 dist 9.04715 8.00386 5.52082 11.2425 12.8292 9.58168 14.5069 13.6215 9.38829 5.9627 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.77392 9.0836 16.492 8.25534 10.3937 9.34312 15.0873 13.5822 14.8724 7.00243 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 6.23539 6.66936 5.95045 5.41599 5.92532 9.35976 10.7239 5.10104 10.7039 8.20644 numMergedOcc 0
