0 mol 19 unq 0 iso 0 dist 8.19695 7.02548 6.60936 8.18566 7.46208 12.0808 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 5.82366 9.85134 10.4685 6.34272 6.39966 11.5929 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.497 6.15893 4.36675 14.3325 9.5053 11.5353 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 7.60283 8.71752 9.51391 14.2471 7.45532 13.843 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.33027 7.32707 6.47508 7.52842 6.15801 9.63403 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 9.33027 7.90574 9.35568 7.52842 6.15801 9.59846 numMergedOcc 0
6 mol 34 unq 2 iso 0 dist 8.2946 9.25346 6.47508 6.51847 6.15801 9.63403 numMergedOcc 0
7 mol 34 unq 3 iso 0 dist 7.32707 9.33027 6.47508 7.52842 9.63403 6.15801 numMergedOcc 0
8 mol 34 unq 4 iso 0 dist 7.32707 7.90574 5.79796 7.52842 9.63403 9.59846 numMergedOcc 0
9 mol 34 unq 5 iso 0 dist 9.25346 8.2946 6.47508 6.51847 9.63403 6.15801 numMergedOcc 0
10 mol 45 unq 0 iso 0 dist 9.62637 7.21995 5.69343 7.91752 9.32898 10.9939 numMergedOcc 0
11 mol 45 unq 1 iso 0 dist 6.01423 7.70625 5.69343 5.73902 9.32898 10.9939 numMergedOcc 0
12 mol 126 unq 0 iso 0 dist 7.36017 5.14819 6.71205 5.83002 5.94233 8.56219 numMergedOcc 0
13 mol 126 unq 1 iso 0 dist 7.36017 6.84245 10.7821 5.83002 5.94233 11.9246 numMergedOcc 0
14 mol 126 unq 2 iso 0 dist 5.14819 7.36017 6.71205 5.83002 8.56219 5.94233 numMergedOcc 0
15 mol 126 unq 3 iso 0 dist 5.14819 6.84245 4.32209 5.83002 8.56219 11.9246 numMergedOcc 0
16 mol 130 unq 0 iso 0 dist 6.90634 9.62236 12.1655 9.52351 8.91311 16.5881 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 4.25566 7.31037 6.33946 11.1956 9.78667 6.73983 numMergedOcc 0
18 mol 141 unq 1 iso 0 dist 4.25566 7.31037 6.33946 9.65952 8.47026 8.6387 numMergedOcc 0
19 mol 141 unq 2 iso 0 dist 7.31037 4.25566 6.33946 11.1956 6.73983 9.78667 numMergedOcc 0
20 mol 141 unq 3 iso 0 dist 7.31037 4.25566 6.33946 9.65952 8.6387 8.47026 numMergedOcc 0
21 mol 141 unq 4 iso 0 dist 5.26989 7.76442 6.55489 8.00633 6.94988 13.147 numMergedOcc 0
22 mol 173 unq 0 iso 0 dist 6.64779 8.41245 7.69792 10.2821 8.03528 12.1172 numMergedOcc 0
23 mol 175 unq 0 iso 0 dist 5.4997 6.99693 6.75531 5.95187 5.89564 5.60528 numMergedOcc 0
24 mol 175 unq 1 iso 0 dist 6.99693 5.4997 6.75531 5.95187 5.60528 5.89564 numMergedOcc 0
25 mol 175 unq 2 iso 0 dist 6.99693 5.4997 6.75531 5.46129 5.5995 9.28409 numMergedOcc 0
26 mol 234 unq 0 iso 0 dist 7.22019 7.94068 9.00021 5.3976 6.00582 11.4382 numMergedOcc 0
27 mol 237 unq 0 iso 0 dist 5.98039 9.48932 5.62416 9.38038 6.07878 7.80422 numMergedOcc 0
28 mol 237 unq 1 iso 0 dist 9.48932 5.98039 5.62416 9.38038 7.80422 6.07878 numMergedOcc 0
29 mol 237 unq 2 iso 0 dist 9.27395 7.55103 6.08027 7.48464 9.54499 9.36216 numMergedOcc 0
30 mol 237 unq 3 iso 0 dist 9.27395 7.55103 6.08027 8.97735 5.6703 8.72819 numMergedOcc 0
31 mol 237 unq 4 iso 0 dist 7.55103 9.27395 6.08027 5.5902 6.11495 11.035 numMergedOcc 0
32 mol 237 unq 5 iso 0 dist 7.55103 9.27395 6.08027 7.48464 9.36216 9.54499 numMergedOcc 0
33 mol 237 unq 6 iso 0 dist 7.55103 9.27395 6.08027 8.97735 8.72819 5.6703 numMergedOcc 0
