0 mol 24 unq 0 iso 0 dist 6.80849 6.74914 4.79736 6.08283 8.09311 7.77964 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.16494 5.51172 4.55481 4.71262 7.18022 7.01952 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 8.16494 5.51172 4.55481 4.28439 6.24711 4.58552 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.51543 8.18572 5.31985 5.4968 6.72869 9.59729 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.79726 8.52697 5.09159 3.89377 9.76379 8.64934 numMergedOcc 0
5 mol 89 unq 0 iso 0 dist 5.25504 5.65453 6.13636 5.72671 5.51831 8.05579 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 6.5258 5.80831 9.05551 4.03471 4.22363 6.96745 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.11612 9.21978 6.63111 3.85674 6.24825 7.65564 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 5.22628 9.26505 6.95773 3.82475 6.39384 7.65564 numMergedOcc 0
9 mol 146 unq 0 iso 0 dist 7.24965 6.76896 8.33152 3.75935 9.04757 7.78784 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 8.79626 9.20504 4.5022 5.66713 5.70635 8.85214 numMergedOcc 0
11 mol 235 unq 1 iso 0 dist 8.79626 6.15704 4.21867 9.92254 5.1823 6.03081 numMergedOcc 0
12 mol 235 unq 2 iso 0 dist 8.79626 6.15704 4.21867 5.66713 5.70635 5.1874 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 8.69557 8.8602 5.71505 4.02386 7.10671 8.20943 numMergedOcc 0
14 mol 243 unq 1 iso 0 dist 4.89168 9.49016 5.71505 6.41173 7.10671 8.20943 numMergedOcc 0
