0 mol 0 unq 0 iso 0 dist 7.37981 7.30381 5.24778 3.70144 10.7845 9.38507 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.87871 6.40741 8.04976 7.58092 12.0852 7.37118 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.54318 9.46554 7.45459 7.84827 13.0122 9.42099 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 5.59773 5.7405 4.29856 7.25076 8.31068 5.27979 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.86724 8.66742 9.52327 5.49646 12.1221 8.4219 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.93703 6.13508 7.45148 8.99475 7.60162 6.21165 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 8.54461 5.05277 6.66056 4.81304 8.81797 8.00013 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 7.83619 5.05277 7.11959 4.81304 5.92733 8.00013 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 9.84695 5.08863 7.92503 6.99467 16.3808 9.59327 numMergedOcc 0
9 mol 147 unq 1 iso 0 dist 9.84695 5.08863 7.92503 4.53687 14.3777 8.51399 numMergedOcc 0
10 mol 147 unq 2 iso 0 dist 9.18866 5.08863 8.93262 6.99467 6.73617 9.59327 numMergedOcc 0
11 mol 147 unq 3 iso 0 dist 9.18866 5.08863 8.93262 4.53687 9.03544 8.51399 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 9.82249 8.62413 4.20425 3.57652 7.93088 5.67088 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 8.69888 9.27911 15.6247 7.97895 12.7901 4.51777 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 8.69888 8.57607 12.7456 7.97895 12.7901 4.9606 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 8.43584 6.05667 11.6232 10.4274 13.5247 7.13824 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 8.68464 6.67239 14.3553 3.79439 8.60731 9.89191 numMergedOcc 0
17 mol 237 unq 0 iso 0 dist 9.39201 5.62039 6.72874 6.41985 13.8173 8.95332 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 8.66451 9.02661 6.70925 9.90818 13.2967 8.09181 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 9.06517 9.7659 6.87875 11.9773 11.0935 9.01437 numMergedOcc 0
20 mol 294 unq 1 iso 0 dist 6.47832 6.1268 5.42688 4.45227 9.25084 9.01437 numMergedOcc 0
