0 mol 11 unq 0 iso 0 dist 5.27564 6.56599 5.11518 12.6523 11.6776 9.09091 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.27564 6.35021 5.19841 12.8869 11.9176 8.73067 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 8.24168 6.35021 6.33035 12.8869 14.2348 8.73067 numMergedOcc 0
3 mol 15 unq 0 iso 0 dist 6.35926 9.11751 4.96682 7.11548 8.3794 6.50647 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.00844 7.24149 13.4501 5.60332 12.7677 7.22361 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.00844 8.63881 10.8459 5.60332 12.7677 6.15893 numMergedOcc 0
6 mol 26 unq 2 iso 0 dist 9.00844 8.63881 10.8459 7.30207 13.0038 5.497 numMergedOcc 0
7 mol 34 unq 0 iso 0 dist 8.95619 9.53262 12.6483 8.43904 16.7104 9.33027 numMergedOcc 0
8 mol 34 unq 1 iso 0 dist 8.95619 9.53262 12.6483 4.81608 11.2021 7.32707 numMergedOcc 0
9 mol 34 unq 2 iso 0 dist 8.95619 9.53262 12.6483 10.5063 14.4856 7.90574 numMergedOcc 0
10 mol 61 unq 0 iso 0 dist 8.80762 9.36265 5.21732 5.57768 11.1405 9.52519 numMergedOcc 0
11 mol 64 unq 0 iso 0 dist 7.32896 5.1488 4.97497 8.95689 5.94373 9.32552 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.07336 8.37295 7.78854 4.11501 11.0457 8.75562 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 8.07336 8.37295 7.78854 7.22151 13.0641 8.00449 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 9.07511 8.8048 4.47525 8.86946 11.8249 8.30984 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 9.02695 7.87044 7.56699 7.07871 13.0323 9.82588 numMergedOcc 0
16 mol 199 unq 0 iso 0 dist 8.93433 8.24056 11.5882 9.36955 17.0514 9.38376 numMergedOcc 0
17 mol 199 unq 1 iso 0 dist 6.93031 8.24056 5.19058 9.36955 12.8297 9.38376 numMergedOcc 0
18 mol 204 unq 0 iso 0 dist 9.85636 6.35305 10.9274 4.92804 13.9786 7.10526 numMergedOcc 0
19 mol 237 unq 0 iso 0 dist 8.28631 6.56421 4.83701 6.45163 9.46558 5.98039 numMergedOcc 0
20 mol 237 unq 1 iso 0 dist 8.28631 6.56421 4.83701 5.11844 11.3211 9.48932 numMergedOcc 0
