0 mol 41 unq 0 iso 0 dist 8.45063 5.31016 12.5752 10.7583 7.64235 14.3379 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 8.45063 5.31016 12.5752 6.24565 6.00623 10.1253 numMergedOcc 0
2 mol 41 unq 2 iso 0 dist 8.45063 5.31016 12.5752 5.14132 6.59367 6.73801 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 8.61357 7.69638 9.98108 4.07863 8.10708 9.43355 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.61448 7.31633 11.3682 6.2062 6.61636 7.34698 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 9.28415 7.6793 10.9933 7.03121 7.82011 10.6484 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 9.21476 9.41073 13.0818 5.81847 9.6818 14.7057 numMergedOcc 0
7 mol 171 unq 0 iso 0 dist 6.20851 6.21194 6.4423 9.38497 7.13078 12.4821 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 6.7407 9.38737 4.67407 10.5012 7.33162 8.41245 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 7.7013 7.42278 7.04147 4.65504 7.77669 7.04177 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 8.40718 8.62191 10.8845 7.96412 9.01377 15.8091 numMergedOcc 0
11 mol 219 unq 0 iso 0 dist 7.26376 7.13099 6.66401 6.16486 9.38761 11.4406 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 8.55805 6.32097 5.45485 10.8658 9.13234 12.299 numMergedOcc 0
13 mol 273 unq 0 iso 0 dist 6.73794 6.38341 7.10817 9.11005 6.59786 8.68913 numMergedOcc 0
14 mol 273 unq 1 iso 0 dist 6.73794 6.38341 7.10817 13.7838 7.96519 10.8919 numMergedOcc 0
15 mol 273 unq 2 iso 0 dist 6.73794 9.78826 4.30863 9.11005 6.59786 10.5134 numMergedOcc 0
16 mol 273 unq 3 iso 0 dist 6.73794 9.78826 4.30863 13.7838 7.96519 8.85779 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 6.90956 7.76945 8.32567 4.26276 8.40198 5.59555 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 6.90956 7.76945 8.32567 9.92609 9.95761 16.1426 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 6.90956 7.76945 8.32567 4.26276 8.40198 5.59555 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 6.90956 7.76945 8.32567 9.92609 9.95761 16.1426 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 6.90956 7.76945 8.32567 4.26276 8.40198 5.59555 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 6.90956 7.76945 8.32567 9.92609 9.95761 16.1426 numMergedOcc 0
