0 mol 33 unq 0 iso 0 dist 9.06004 9.34266 4.43305 9.8286 4.64187 7.95437 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 9.34266 9.06004 4.43305 9.8286 7.95437 4.64187 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 6.72584 7.25594 5.72008 9.40112 5.35861 8.61641 numMergedOcc 0
3 mol 83 unq 1 iso 0 dist 7.25594 6.72584 5.72008 9.40112 8.61641 5.35861 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 7.87345 9.01196 10.8895 3.50778 5.92828 11.3803 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 7.87345 9.01196 10.8895 9.07396 9.1247 16.7734 numMergedOcc 0
6 mol 158 unq 0 iso 0 dist 4.80508 4.88625 3.19759 5.65593 9.44964 10.4582 numMergedOcc 0
7 mol 168 unq 0 iso 0 dist 6.24232 6.13116 5.29906 4.562 7.0961 8.26768 numMergedOcc 0
8 mol 168 unq 1 iso 0 dist 6.24232 6.13116 5.29906 14.2661 8.21227 11.0485 numMergedOcc 0
9 mol 168 unq 2 iso 0 dist 6.24232 6.13116 5.29906 9.56342 6.53038 9.04677 numMergedOcc 0
10 mol 168 unq 3 iso 0 dist 8.1953 8.16253 5.29906 14.7953 7.0961 8.26768 numMergedOcc 0
11 mol 168 unq 4 iso 0 dist 8.1953 8.16253 5.29906 9.96378 8.21227 11.0485 numMergedOcc 0
12 mol 168 unq 5 iso 0 dist 8.1953 8.16253 5.29906 6.11883 6.53038 9.04677 numMergedOcc 0
13 mol 168 unq 6 iso 0 dist 6.13116 6.24232 5.29906 4.562 8.26768 7.0961 numMergedOcc 0
14 mol 168 unq 7 iso 0 dist 8.16253 8.1953 5.29906 14.7953 8.26768 7.0961 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 9.03941 8.69094 5.75027 8.67769 7.65903 9.799 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 7.79098 9.15923 8.04915 7.85099 5.23187 11.6495 numMergedOcc 0
17 mol 184 unq 1 iso 0 dist 6.30144 6.03505 8.04915 6.97246 5.23187 11.6495 numMergedOcc 0
18 mol 198 unq 0 iso 0 dist 6.49746 5.8917 3.09303 5.9839 7.04521 8.85265 numMergedOcc 0
19 mol 198 unq 1 iso 0 dist 5.8917 6.49746 3.09303 5.9839 8.85265 7.04521 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 6.23874 6.68956 4.68872 5.96447 8.06767 11.2304 numMergedOcc 0
21 mol 287 unq 1 iso 0 dist 6.23874 6.68956 4.68872 15.4087 9.91087 13.8971 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 6.23874 6.68956 4.68872 5.96447 8.06767 11.2304 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 6.23874 6.68956 4.68872 15.4087 9.91087 13.8971 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 6.23874 6.68956 4.68872 5.96447 8.06767 11.2304 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 6.23874 6.68956 4.68872 15.4087 9.91087 13.8971 numMergedOcc 0
