0 mol 5 unq 0 iso 0 dist 5.04052 7.0627 3.33561 8.59201 9.22027 7.56229 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.87863 8.80355 9.50135 15.8695 9.22027 15.7507 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 6.46284 7.62938 5.31713 4.07888 4.98321 8.87945 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 9.05612 9.64287 5.38692 10.6401 8.75345 12.9254 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 6.93938 7.87345 12.3755 6.00039 6.96745 9.24706 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 6.93938 9.01196 5.70307 6.00039 6.96745 9.79038 numMergedOcc 0
6 mol 122 unq 0 iso 0 dist 5.42764 8.88554 6.58474 5.69357 9.47049 13.6016 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 6.22696 4.80508 5.09517 5.65593 9.10671 9.44964 numMergedOcc 0
8 mol 158 unq 1 iso 0 dist 6.22696 4.88625 6.2149 5.65593 9.10671 10.4582 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 4.68544 8.1953 8.60565 6.11883 8.32353 6.53038 numMergedOcc 0
10 mol 168 unq 1 iso 0 dist 4.68544 8.16253 5.62227 6.11883 8.32353 9.04677 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 8.32647 6.03505 11.1533 6.97246 4.61596 11.6495 numMergedOcc 0
12 mol 184 unq 1 iso 0 dist 8.32647 6.30144 3.74437 6.97246 4.61596 5.23187 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 9.42723 6.49746 3.70259 5.9839 9.91727 7.04521 numMergedOcc 0
14 mol 198 unq 1 iso 0 dist 9.42723 5.8917 5.13258 5.9839 9.91727 8.85265 numMergedOcc 0
15 mol 198 unq 2 iso 0 dist 7.70823 9.70373 3.70259 12.5506 9.91727 7.04521 numMergedOcc 0
16 mol 198 unq 3 iso 0 dist 8.16611 9.76877 3.70259 10.8876 9.91727 7.04521 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 8.9694 6.03628 5.22858 15.6849 9.43017 14.2281 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 8.02723 9.22105 9.08285 9.1215 9.43017 11.8381 numMergedOcc 0
19 mol 214 unq 2 iso 0 dist 8.70011 7.81831 3.64285 6.3054 4.85332 6.50654 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 6.16312 5.27463 5.88058 4.59989 9.86835 9.05084 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 9.97859 9.59909 14.95 6.10342 4.66186 12.4575 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 7.18462 8.26365 3.08474 10.2114 9.23612 9.21469 numMergedOcc 0
