0 mol 44 unq 0 iso 0 dist 9.60845 5.23045 7.49423 12.4909 11.1199 7.42925 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.79378 5.73909 5.2568 9.27409 6.67753 9.81193 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 9.7691 7.57955 5.2568 13.5957 6.67753 9.81193 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.18214 7.13073 4.90093 7.07989 3.99506 6.34966 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.23055 8.39416 9.22123 9.7872 3.77771 7.2131 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 8.23055 8.39416 9.22123 13.4254 9.8974 7.44343 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 8.30746 10.4946 9.22123 10.2815 3.77771 7.2131 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 8.30746 10.4946 9.22123 13.8011 9.8974 7.44343 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 6.58814 12.7865 9.15802 9.82649 4.76749 5.76109 numMergedOcc 0
9 mol 93 unq 1 iso 0 dist 6.58814 12.7865 9.15802 7.4518 5.73248 8.0955 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.48934 8.34522 7.43587 6.78469 5.16197 9.80549 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 6.41183 7.89112 7.43587 8.01453 5.16197 9.80549 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 8.00119 7.93856 8.58178 9.22159 4.82566 5.5781 numMergedOcc 0
13 mol 183 unq 1 iso 0 dist 5.50896 7.93856 4.77438 9.22159 3.74873 5.5781 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 8.25174 4.02883 6.11886 10.2258 5.89269 7.32556 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 8.25174 4.02883 6.11886 10.9338 5.27881 9.28689 numMergedOcc 0
16 mol 205 unq 2 iso 0 dist 8.25174 4.02883 6.11886 10.6756 10.7019 9.1654 numMergedOcc 0
17 mol 205 unq 3 iso 0 dist 9.16671 8.28418 6.11886 11.9644 5.89269 7.32556 numMergedOcc 0
18 mol 205 unq 4 iso 0 dist 9.16671 8.28418 6.11886 10.5525 5.27881 9.28689 numMergedOcc 0
19 mol 205 unq 5 iso 0 dist 9.16671 8.28418 6.11886 12.4034 10.7019 9.1654 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 9.33231 6.26246 5.12878 8.42502 3.68966 5.62039 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 7.88108 13.9464 8.43724 16.1539 9.71158 9.56846 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 5.8898 4.86847 6.80043 10.2019 6.31696 7.49913 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 8.24013 4.54209 9.48076 10.1675 12.1127 5.92532 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 9.1471 9.43452 9.78064 7.76945 3.96271 8.9316 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 9.1471 9.43452 9.78064 7.76945 3.96271 8.9316 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 9.1471 9.43452 9.78064 7.76945 3.96271 8.9316 numMergedOcc 0
