0 mol 5 unq 0 iso 0 dist 8.62847 11.5151 8.97274 7.24092 9.22027 11.3755 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.62847 4.25268 7.5815 7.24092 9.22027 5.90479 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.8014 4.3044 7.50377 6.73987 5.7369 6.50041 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.18572 5.51994 6.55112 5.4968 9.59729 6.38237 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 8.52697 4.82573 8.26763 3.89377 8.64934 4.0291 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 8.37559 4.85263 5.58681 5.46771 8.16401 4.21899 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 6.6142 5.60885 9.8896 3.98194 5.42044 8.2382 numMergedOcc 0
7 mol 197 unq 0 iso 0 dist 9.67667 7.15682 7.86042 8.58041 6.69042 3.35829 numMergedOcc 0
8 mol 222 unq 0 iso 0 dist 8.79662 8.84473 6.71817 5.03056 5.72 6.4817 numMergedOcc 0
9 mol 222 unq 1 iso 0 dist 6.6497 8.84473 8.41524 5.03056 6.84052 6.4817 numMergedOcc 0
10 mol 222 unq 2 iso 0 dist 6.6497 8.84473 8.41524 3.91348 9.58086 8.05936 numMergedOcc 0
11 mol 235 unq 0 iso 0 dist 6.15704 10.3913 7.93194 9.92254 6.03081 3.89748 numMergedOcc 0
12 mol 235 unq 1 iso 0 dist 6.15704 10.3913 7.93194 5.66713 5.1874 5.99438 numMergedOcc 0
13 mol 251 unq 0 iso 0 dist 8.99048 14.1748 9.65275 15.6828 9.02417 4.66259 numMergedOcc 0
