0 mol 25 unq 0 iso 0 dist 9.86224 13.6714 6.29797 14.6002 5.68392 7.6114 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.7004 5.21951 6.81793 13.7115 6.04762 9.12845 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 4.73362 6.65453 7.46095 8.41567 4.85247 6.72869 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 4.73362 6.65453 7.46095 5.56964 6.45686 9.85905 numMergedOcc 0
4 mol 76 unq 2 iso 0 dist 7.3795 7.15288 7.46095 6.62246 4.85247 6.72869 numMergedOcc 0
5 mol 76 unq 3 iso 0 dist 7.3795 7.15288 7.46095 12.885 6.45686 9.85905 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 9.21645 5.02595 6.18678 10.5947 6.36778 9.77575 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 8.61279 5.78168 5.29898 12.7314 7.42649 8.07097 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 5.76862 5.32843 8.71789 10.0704 7.51976 8.33439 numMergedOcc 0
9 mol 154 unq 1 iso 0 dist 5.92763 5.32843 5.2693 10.0704 7.23684 8.33439 numMergedOcc 0
10 mol 162 unq 0 iso 0 dist 8.24791 9.10646 8.33407 15.39 10.1865 7.45998 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.50938 10.3533 7.35884 11.0615 4.43096 9.76212 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.50938 10.3533 7.35884 14.3418 6.06566 8.59874 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 6.62013 12.1769 9.48625 11.513 5.86489 7.9133 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 6.65275 9.92572 8.91971 12.9898 10.9607 5.23634 numMergedOcc 0
15 mol 227 unq 1 iso 0 dist 6.65275 9.92572 8.91971 14.1659 9.72615 6.91318 numMergedOcc 0
16 mol 227 unq 2 iso 0 dist 9.90065 12.598 9.18728 13.7795 6.35849 5.23634 numMergedOcc 0
17 mol 227 unq 3 iso 0 dist 9.90065 12.598 9.18728 17.4849 10.204 6.91318 numMergedOcc 0
18 mol 252 unq 0 iso 0 dist 9.1191 8.846 8.09509 13.4304 6.35641 7.15764 numMergedOcc 0
19 mol 267 unq 0 iso 0 dist 5.32817 5.39987 6.27154 12.435 9.14203 8.8293 numMergedOcc 0
20 mol 267 unq 1 iso 0 dist 5.32817 5.39987 6.27154 9.55141 8.37094 7.34981 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 8.6522 7.51644 7.17958 12.0882 12.6502 6.35028 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 7.31529 3.75346 7.17958 9.65846 12.6502 6.35028 numMergedOcc 0
23 mol 279 unq 2 iso 0 dist 5.21664 5.03816 7.17958 8.68797 12.6502 6.35028 numMergedOcc 0
