0 mol 0 unq 0 iso 0 dist 7.46173 9.19007 10.7182 6.91778 5.15929 14.0232 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.46173 9.56794 5.19175 6.91778 5.15929 10.1804 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 7.89702 7.92414 6.26525 7.03958 5.13275 8.07902 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 7.89702 6.82379 6.23898 7.03958 5.13275 5.65816 numMergedOcc 0
4 mol 8 unq 2 iso 0 dist 5.89134 7.3915 5.90317 8.53529 6.38783 5.65816 numMergedOcc 0
5 mol 9 unq 0 iso 0 dist 6.79837 7.9944 10.5718 6.55811 9.84125 4.58685 numMergedOcc 0
6 mol 9 unq 1 iso 0 dist 6.79837 7.9944 10.5718 7.36018 6.12805 5.83039 numMergedOcc 0
7 mol 9 unq 2 iso 0 dist 6.79837 7.9944 10.5718 8.48677 7.26017 9.06304 numMergedOcc 0
8 mol 9 unq 3 iso 0 dist 8.07369 7.032 10.5718 8.64915 9.84125 4.58685 numMergedOcc 0
9 mol 9 unq 4 iso 0 dist 8.07369 7.032 10.5718 8.17347 6.12805 5.83039 numMergedOcc 0
10 mol 9 unq 5 iso 0 dist 8.07369 7.032 10.5718 7.83133 6.78475 9.193 numMergedOcc 0
11 mol 19 unq 0 iso 0 dist 7.97324 6.92532 11.8506 7.75618 10.3824 13.9675 numMergedOcc 0
12 mol 52 unq 0 iso 0 dist 5.75761 9.66501 5.58144 6.31696 10.9229 12.6605 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 6.69217 8.56342 12.831 6.52773 7.03042 6.96805 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 6.69217 8.56342 12.831 9.23858 10.0127 13.3975 numMergedOcc 0
15 mol 119 unq 2 iso 0 dist 6.69217 6.37542 5.57116 6.52773 7.03042 4.86811 numMergedOcc 0
16 mol 119 unq 3 iso 0 dist 6.69217 6.37542 5.57116 9.23858 10.0127 8.00229 numMergedOcc 0
17 mol 170 unq 0 iso 0 dist 9.48574 8.15099 13.6753 6.35982 10.5942 7.29587 numMergedOcc 0
18 mol 170 unq 1 iso 0 dist 9.48574 8.15099 13.6753 7.51126 5.6109 8.73585 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 6.42016 6.60567 10.9731 7.36683 10.9989 6.0634 numMergedOcc 0
20 mol 195 unq 1 iso 0 dist 6.42016 6.60567 10.9731 6.95086 6.66806 6.74112 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 7.72403 8.24186 9.42254 9.81425 10.8078 9.68666 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 7.27632 9.007 9.47702 6.30154 12.1933 7.82953 numMergedOcc 0
23 mol 234 unq 2 iso 0 dist 7.27632 9.007 9.47702 7.32499 5.20198 5.76537 numMergedOcc 0
24 mol 240 unq 0 iso 0 dist 7.55134 9.47583 7.12941 6.68687 10.9665 15.5587 numMergedOcc 0
25 mol 274 unq 0 iso 0 dist 6.92434 9.56685 8.18664 9.85289 4.67674 5.36428 numMergedOcc 0
26 mol 274 unq 1 iso 0 dist 6.92434 8.49922 12.3345 9.85289 4.67674 11.9754 numMergedOcc 0
27 mol 274 unq 2 iso 0 dist 6.93875 9.56685 13.1228 9.85289 14.1093 5.36428 numMergedOcc 0
28 mol 274 unq 3 iso 0 dist 6.93875 8.49922 10.5821 9.85289 14.1093 11.9754 numMergedOcc 0
29 mol 274 unq 4 iso 0 dist 6.0868 9.56685 10.9933 9.85289 13.6948 5.36428 numMergedOcc 0
30 mol 274 unq 5 iso 0 dist 6.0868 8.49922 5.66773 9.85289 13.6948 11.9754 numMergedOcc 0
31 mol 274 unq 6 iso 0 dist 6.32856 9.56685 11.0219 9.85289 13.6849 5.36428 numMergedOcc 0
32 mol 274 unq 7 iso 0 dist 6.32856 8.49922 5.67921 9.85289 13.6849 11.9754 numMergedOcc 0
