0 mol 24 unq 0 iso 0 dist 8.52839 10.4706 9.58012 11.34 4.36056 8.70141 numMergedOcc 0
1 mol 90 unq 0 iso 0 dist 7.63894 12.9414 8.83296 16.1929 13.6843 9.99316 numMergedOcc 0
2 mol 90 unq 1 iso 0 dist 6.17315 14.6058 8.83296 19.2411 13.6843 9.99316 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 9.92785 11.8293 7.8674 8.52947 12.3147 8.42713 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 9.92785 11.8293 7.8674 17.8376 9.97789 8.21032 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 8.21739 3.74136 5.51624 8.84466 8.02579 8.42713 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 8.21739 3.74136 5.51624 9.2948 12.1011 8.21032 numMergedOcc 0
7 mol 93 unq 4 iso 0 dist 4.78377 3.74136 7.8674 8.84466 12.3147 8.42713 numMergedOcc 0
8 mol 93 unq 5 iso 0 dist 4.78377 3.74136 7.8674 9.2948 9.97789 8.21032 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 6.20301 8.18162 5.46988 4.87856 3.95956 8.78681 numMergedOcc 0
10 mol 109 unq 1 iso 0 dist 9.97865 6.16181 5.46988 12.6276 8.81106 7.49224 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 7.03509 5.57363 7.63127 12.5885 8.25036 9.07172 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 7.83509 4.52246 9.23528 5.03663 6.96543 6.4752 numMergedOcc 0
13 mol 147 unq 1 iso 0 dist 7.01483 5.88056 9.23528 8.93916 6.96543 6.4752 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 7.67051 6.25864 7.3546 11.8301 16.5085 9.3832 numMergedOcc 0
15 mol 163 unq 1 iso 0 dist 7.67051 6.25864 7.3546 9.49761 6.56076 6.0247 numMergedOcc 0
16 mol 163 unq 2 iso 0 dist 7.67051 6.25864 7.3546 8.92725 9.55758 6.40873 numMergedOcc 0
17 mol 163 unq 3 iso 0 dist 9.07256 15.1824 7.3546 12.6868 3.64474 5.80513 numMergedOcc 0
18 mol 171 unq 0 iso 0 dist 8.2866 6.71449 9.75627 12.5768 14.0377 7.68295 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 9.67802 14.8027 8.12349 14.7835 9.52773 9.93045 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 9.18314 6.14396 8.12349 4.85577 9.52773 9.93045 numMergedOcc 0
21 mol 218 unq 0 iso 0 dist 7.84953 13.3105 8.93185 11.8619 5.77167 5.72444 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 7.10883 8.96094 6.53728 13.8426 7.01029 8.28454 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 8.82933 8.76033 6.47194 9.98868 4.88527 8.15795 numMergedOcc 0
