0 mol 10 unq 0 iso 0 dist 6.74091 4.89243 5.06897 14.3304 11.2691 9.64891 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 5.29367 3.69603 7.53604 7.10804 6.90338 7.85234 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 5.29367 8.35279 8.85591 15.3102 12.0752 9.6643 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 8.07937 3.69603 9.70778 7.10804 5.29322 7.85234 numMergedOcc 0
4 mol 26 unq 3 iso 0 dist 6.42206 13.9878 9.70778 8.64424 5.29322 7.85234 numMergedOcc 0
5 mol 26 unq 4 iso 0 dist 9.66602 19.215 9.70778 13.407 5.29322 7.85234 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 8.20049 7.47204 5.64067 11.9493 12.9268 7.96082 numMergedOcc 0
7 mol 86 unq 0 iso 0 dist 8.50853 5.84773 8.71941 10.8256 4.21804 9.39011 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 8.52947 11.8293 8.42713 17.4004 12.7083 5.89661 numMergedOcc 0
9 mol 93 unq 1 iso 0 dist 8.84466 3.74136 8.42713 9.27407 12.7083 5.89661 numMergedOcc 0
10 mol 93 unq 2 iso 0 dist 9.2948 3.74136 8.21032 9.27407 7.44572 5.89661 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 8.87505 4.91324 6.62468 7.50959 5.76927 7.67321 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 5.70772 5.78019 6.4752 15.6965 14.5183 9.95533 numMergedOcc 0
13 mol 147 unq 1 iso 0 dist 5.70772 5.78019 6.4752 10.5369 13.8716 7.94147 numMergedOcc 0
14 mol 147 unq 2 iso 0 dist 5.03663 4.52246 6.4752 13.6576 14.5183 9.95533 numMergedOcc 0
15 mol 147 unq 3 iso 0 dist 5.03663 4.52246 6.4752 11.3343 13.8716 7.94147 numMergedOcc 0
16 mol 147 unq 4 iso 0 dist 8.93916 5.88056 6.4752 10.2474 14.5183 9.95533 numMergedOcc 0
17 mol 147 unq 5 iso 0 dist 8.93916 5.88056 6.4752 11.787 13.8716 7.94147 numMergedOcc 0
18 mol 173 unq 0 iso 0 dist 9.99743 9.37181 5.36078 16.33 8.46059 8.44479 numMergedOcc 0
19 mol 173 unq 1 iso 0 dist 9.99743 9.37181 5.36078 16.7313 11.3004 9.00002 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.6011 17.4337 9.47421 21.4084 14.7563 9.40296 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 5.49794 4.81143 5.63154 5.90003 8.29352 7.84195 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 5.49794 4.81143 5.63154 11.0386 6.34006 9.2174 numMergedOcc 0
