0 mol 0 unq 0 iso 0 dist 7.48645 6.0597 6.64713 6.3267 4.04089 8.34244 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.82483 6.0397 8.076 7.2199 6.81435 9.57198 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.93364 6.45654 6.15801 11.4795 7.52842 9.33027 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 6.93364 6.45654 6.15801 7.71914 6.51847 8.2946 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 6.93364 11.9626 9.63403 11.4795 7.52842 7.32707 numMergedOcc 0
5 mol 34 unq 3 iso 0 dist 6.93364 11.9626 9.63403 7.71914 6.51847 9.25346 numMergedOcc 0
6 mol 34 unq 4 iso 0 dist 6.34821 7.35043 6.15801 13.2701 7.52842 9.33027 numMergedOcc 0
7 mol 34 unq 5 iso 0 dist 6.34821 7.35043 6.15801 10.583 6.51847 8.2946 numMergedOcc 0
8 mol 34 unq 6 iso 0 dist 6.34821 13.4874 9.63403 13.2701 7.52842 7.32707 numMergedOcc 0
9 mol 34 unq 7 iso 0 dist 6.34821 13.4874 9.63403 10.583 6.51847 9.25346 numMergedOcc 0
10 mol 45 unq 0 iso 0 dist 7.95778 6.39184 8.80014 8.13782 4.52443 5.55096 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.06525 9.47219 9.35942 9.86739 8.36453 9.83981 numMergedOcc 0
12 mol 114 unq 1 iso 0 dist 8.06525 9.47219 9.35942 10.3192 6.22315 6.13559 numMergedOcc 0
13 mol 114 unq 2 iso 0 dist 8.06525 9.47219 9.35942 9.49413 6.18257 6.51395 numMergedOcc 0
14 mol 114 unq 3 iso 0 dist 8.11094 6.76585 9.17466 9.86739 7.70536 8.809 numMergedOcc 0
15 mol 114 unq 4 iso 0 dist 8.11094 6.76585 9.17466 8.39249 4.69847 5.79343 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 7.59814 6.15037 7.82544 6.98849 9.24851 6.87262 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 8.07135 6.61001 6.18808 11.831 6.19569 6.87262 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 9.7775 6.15037 6.18808 6.98849 6.19569 6.87262 numMergedOcc 0
19 mol 158 unq 0 iso 0 dist 7.35329 6.93752 5.8628 16.1008 10.6936 9.6096 numMergedOcc 0
20 mol 175 unq 0 iso 0 dist 7.01126 4.30489 5.89564 4.79852 5.95187 5.4997 numMergedOcc 0
21 mol 175 unq 1 iso 0 dist 7.01126 4.57622 5.60528 10.1855 6.05776 8.99988 numMergedOcc 0
22 mol 175 unq 2 iso 0 dist 7.01126 4.57622 5.60528 4.79852 5.95187 6.99693 numMergedOcc 0
23 mol 175 unq 3 iso 0 dist 6.58434 4.57622 5.5995 10.1855 5.85047 8.99988 numMergedOcc 0
24 mol 175 unq 4 iso 0 dist 6.58434 4.57622 5.5995 4.79852 5.46129 6.99693 numMergedOcc 0
25 mol 186 unq 0 iso 0 dist 7.94153 5.34643 7.02575 12.2271 6.20673 8.97471 numMergedOcc 0
26 mol 193 unq 0 iso 0 dist 8.76185 10.8409 7.8141 12.8549 5.91268 7.60625 numMergedOcc 0
27 mol 194 unq 0 iso 0 dist 9.77862 5.63279 5.68348 10.055 7.69247 8.52969 numMergedOcc 0
28 mol 225 unq 0 iso 0 dist 5.13453 6.16433 8.20162 7.51827 7.13893 7.73748 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 9.06084 6.56416 6.00582 12.2448 6.56378 9.25517 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 9.06084 6.56416 6.00582 5.32183 5.3976 7.22019 numMergedOcc 0
31 mol 237 unq 0 iso 0 dist 7.33613 4.7134 6.07878 10.6632 9.38038 5.98039 numMergedOcc 0
32 mol 237 unq 1 iso 0 dist 7.33613 6.42587 7.80422 10.6632 9.38038 9.48932 numMergedOcc 0
33 mol 243 unq 0 iso 0 dist 6.01071 4.78857 7.44706 9.1101 8.16841 7.12785 numMergedOcc 0
34 mol 243 unq 1 iso 0 dist 6.01071 4.78857 7.44706 8.93338 6.03041 6.66959 numMergedOcc 0
35 mol 250 unq 0 iso 0 dist 9.03319 4.45194 5.93798 8.16469 7.62569 6.28538 numMergedOcc 0
