0 mol 24 unq 0 iso 0 dist 8.94703 13.7241 9.03541 6.11056 4.79736 9.90845 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.37435 6.90106 9.21084 6.89136 7.12408 8.94292 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 9.62411 7.3581 8.80745 10.3433 5.95511 5.94778 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 7.31989 10.6622 8.80745 11.7189 5.95511 5.94778 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 8.85156 7.63046 8.63912 6.36193 4.23671 7.84983 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 8.85156 7.63046 8.63912 4.88613 5.6823 9.56737 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.42184 10.3721 7.75341 19.5459 14.4586 9.28253 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.10803 12.1048 7.14258 5.63005 8.84069 9.42766 numMergedOcc 0
8 mol 175 unq 0 iso 0 dist 9.72263 6.57343 8.87876 10.4663 5.57734 9.00898 numMergedOcc 0
9 mol 206 unq 0 iso 0 dist 8.79378 4.58247 5.83021 9.78438 7.89575 9.72979 numMergedOcc 0
10 mol 206 unq 1 iso 0 dist 8.79378 4.58247 5.83021 10.1863 5.14674 6.97859 numMergedOcc 0
11 mol 207 unq 0 iso 0 dist 6.50724 9.63971 6.06003 14.643 8.23012 8.09522 numMergedOcc 0
12 mol 207 unq 1 iso 0 dist 6.50724 9.63971 6.06003 10.0544 4.56899 5.08312 numMergedOcc 0
13 mol 235 unq 0 iso 0 dist 5.39924 4.26151 5.38046 9.49136 13.089 9.71281 numMergedOcc 0
14 mol 235 unq 1 iso 0 dist 5.39924 4.26151 5.38046 12.9389 11.8321 9.2433 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 6.96382 15.2081 8.28643 15.7611 10.1427 6.83152 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 6.96382 15.2081 8.28643 11.6545 5.71717 5.24313 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 7.63381 7.04644 7.69491 13.2218 10.6736 6.37342 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 8.89714 12.565 5.63226 20.6924 12.634 8.90885 numMergedOcc 0
19 mol 273 unq 1 iso 0 dist 8.89714 12.565 5.63226 20.7068 14.4568 9.96963 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 7.81241 12.3631 9.4181 12.6822 7.83976 9.53225 numMergedOcc 0
