0 mol 26 unq 0 iso 0 dist 8.84763 7.85533 7.89222 10.6287 7.3022 14.0527 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.74242 12.5403 9.53735 9.01242 7.22361 5.19563 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.74242 12.5403 9.53735 7.89464 6.15893 14.2716 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 9.74242 12.6057 9.34599 9.01242 7.22361 14.7857 numMergedOcc 0
4 mol 26 unq 4 iso 0 dist 9.74242 12.6057 9.34599 7.89464 6.15893 7.23962 numMergedOcc 0
5 mol 27 unq 0 iso 0 dist 9.61335 15.1609 5.80623 12.5648 7.60283 10.1283 numMergedOcc 0
6 mol 27 unq 1 iso 0 dist 9.61335 10.5197 7.24775 12.5648 7.60283 3.71754 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 7.63526 5.12242 5.39827 8.05989 7.46994 6.35361 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.33276 14.2921 8.22984 11.3473 7.09065 12.1174 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 9.33276 11.9339 6.6157 11.3473 7.09065 7.39527 numMergedOcc 0
10 mol 100 unq 2 iso 0 dist 9.33276 8.93457 7.37771 11.3473 7.09065 5.22124 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 6.37224 5.75619 6.87901 10.1316 9.07734 7.80268 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 6.75179 10.7909 8.12514 10.6528 7.70313 5.23522 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 9.73325 18.9898 9.96946 13.5529 6.90634 6.91022 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 8.21272 11.0717 9.32254 13.0233 6.87262 6.41401 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 6.03852 11.8146 9.14007 5.29975 5.26989 6.70767 numMergedOcc 0
16 mol 141 unq 1 iso 0 dist 8.97069 12.6229 9.14007 6.38237 5.26989 6.70767 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 8.31165 5.51026 5.79682 13.9147 7.48235 9.91475 numMergedOcc 0
