0 mol 11 unq 0 iso 0 dist 5.87616 6.27964 7.53641 6.82612 9.56493 5.8689 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 6.91627 5.76006 7.18195 9.77151 15.7964 9.86138 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.29367 5.272 5.56136 6.84156 10.1396 6.40556 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 8.07937 5.272 6.58799 6.84156 12.6263 6.40556 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 8.61226 8.51968 9.80682 4.35816 9.57332 5.23215 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 8.48514 7.8855 7.03311 12.6714 10.9443 8.29508 numMergedOcc 0
6 mol 55 unq 1 iso 0 dist 8.57785 7.8855 7.72419 12.6714 7.03751 8.29508 numMergedOcc 0
7 mol 55 unq 2 iso 0 dist 7.03751 8.29508 7.72419 12.6714 8.57785 7.8855 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 5.35101 6.89262 7.7624 5.11838 8.68381 6.50646 numMergedOcc 0
9 mol 58 unq 1 iso 0 dist 8.68381 6.50646 7.7624 5.11838 5.35101 6.89262 numMergedOcc 0
10 mol 110 unq 0 iso 0 dist 8.36172 7.67702 11.3462 4.50939 12.2717 7.1891 numMergedOcc 0
11 mol 123 unq 0 iso 0 dist 7.25497 6.36344 4.10446 5.29746 10.9712 8.71375 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.65932 5.82588 6.83142 7.00937 12.8488 7.97262 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 6.65932 5.82588 6.83142 4.36759 10.4374 9.90846 numMergedOcc 0
14 mol 176 unq 0 iso 0 dist 9.84843 8.12047 16.5596 10.7245 18.1647 6.02559 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 6.01193 9.99681 6.04517 4.36175 7.40749 9.89626 numMergedOcc 0
16 mol 233 unq 1 iso 0 dist 7.40749 9.89626 6.04517 4.36175 6.01193 9.99681 numMergedOcc 0
17 mol 256 unq 0 iso 0 dist 9.36652 6.07677 8.22925 4.35953 7.54613 7.56605 numMergedOcc 0
18 mol 256 unq 1 iso 0 dist 7.54613 7.56605 8.22925 4.35953 9.36652 6.07677 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 9.83854 9.19106 13.5875 3.62968 10.2027 5.81967 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.8678 6.55208 4.98576 4.34107 9.10275 7.17562 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 8.00278 6.55208 4.0473 4.34107 6.13722 7.17562 numMergedOcc 0
22 mol 266 unq 2 iso 0 dist 9.10275 7.17562 4.98576 4.34107 9.8678 6.55208 numMergedOcc 0
23 mol 266 unq 3 iso 0 dist 6.13722 7.17562 4.0473 4.34107 8.00278 6.55208 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 9.37044 4.28058 5.26936 7.42275 12.5966 9.59064 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 9.37044 4.28058 5.26936 7.42275 12.5966 9.59064 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 9.37044 4.28058 5.26936 7.42275 12.5966 9.59064 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 8.74181 7.71392 14.4135 5.89 14.4521 6.6112 numMergedOcc 0
28 mol 294 unq 1 iso 0 dist 8.74181 5.02677 8.04862 5.89 14.4521 8.34193 numMergedOcc 0
29 mol 294 unq 2 iso 0 dist 8.74181 7.6859 14.4859 5.89 14.4521 8.35722 numMergedOcc 0
30 mol 294 unq 3 iso 0 dist 8.96987 7.71392 15.5959 5.89 14.5006 6.6112 numMergedOcc 0
31 mol 294 unq 4 iso 0 dist 8.96987 5.02677 11.4159 5.89 14.5006 8.34193 numMergedOcc 0
32 mol 294 unq 5 iso 0 dist 8.96987 7.6859 11.2968 5.89 14.5006 8.35722 numMergedOcc 0
