0 mol 0 unq 0 iso 0 dist 6.3267 7.92928 5.96303 6.0597 8.34244 10.8762 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.3267 7.48645 4.04089 6.0597 8.34244 6.64713 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 7.2199 9.82483 6.81435 6.0397 9.57198 8.076 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 7.71914 6.93364 6.51847 6.45654 8.2946 6.15801 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 7.71914 6.93364 6.51847 11.9626 9.25346 9.63403 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 8.13782 7.95778 4.52443 6.39184 5.55096 8.80014 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 9.86739 8.11094 7.70536 6.76585 8.809 9.17466 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 9.86739 8.06525 8.36453 9.47219 9.83981 9.35942 numMergedOcc 0
8 mol 114 unq 2 iso 0 dist 9.49413 8.06525 6.18257 9.47219 6.51395 9.35942 numMergedOcc 0
9 mol 114 unq 3 iso 0 dist 8.39249 8.11094 4.69847 6.76585 5.79343 9.17466 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 6.98849 7.59814 9.24851 6.15037 6.87262 7.82544 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 6.98849 9.7775 6.19569 6.15037 6.87262 6.18808 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 6.4218 8.77898 9.10548 12.2578 6.93279 15.7897 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 9.79554 7.79505 5.63016 12.6533 8.41245 11.8533 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 9.79554 7.79505 5.63016 15.1434 6.64779 12.2109 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 4.79852 7.01126 5.95187 4.30489 5.4997 5.89564 numMergedOcc 0
16 mol 175 unq 1 iso 0 dist 4.79852 7.01126 5.95187 4.57622 6.99693 5.60528 numMergedOcc 0
17 mol 175 unq 2 iso 0 dist 4.79852 6.58434 5.46129 4.30489 5.4997 9.28409 numMergedOcc 0
18 mol 175 unq 3 iso 0 dist 4.79852 6.58434 5.46129 4.57622 6.99693 5.5995 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 8.75834 5.13453 7.15437 17.6349 9.47117 16.3562 numMergedOcc 0
20 mol 225 unq 1 iso 0 dist 8.75834 7.95883 15.2958 17.6349 9.47117 23.6297 numMergedOcc 0
21 mol 225 unq 2 iso 0 dist 7.51827 5.13453 7.13893 6.16433 7.73748 8.20162 numMergedOcc 0
22 mol 225 unq 3 iso 0 dist 7.51827 7.95883 10.4901 6.16433 7.73748 11.2163 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 7.95168 7.89801 5.92529 9.75331 7.57454 12.135 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 9.6101 9.06084 9.66782 4.51304 7.43663 11.4382 numMergedOcc 0
25 mol 234 unq 1 iso 0 dist 5.32183 9.06084 5.3976 4.51304 7.94068 11.4382 numMergedOcc 0
26 mol 234 unq 2 iso 0 dist 5.32183 9.06084 5.3976 6.56416 7.22019 6.00582 numMergedOcc 0
27 mol 243 unq 0 iso 0 dist 9.1101 6.01071 8.16841 4.78857 7.12785 7.44706 numMergedOcc 0
28 mol 243 unq 1 iso 0 dist 8.93338 6.01071 6.03041 4.78857 6.66959 7.44706 numMergedOcc 0
29 mol 250 unq 0 iso 0 dist 8.16469 9.03319 7.62569 4.45194 6.28538 5.93798 numMergedOcc 0
