0 mol 27 unq 0 iso 0 dist 5.27118 9.75252 5.52651 5.60515 9.29273 14.6217 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.6127 9.25005 4.74094 5.08831 8.0991 9.95093 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 8.6127 9.25005 4.74094 6.54316 8.80175 12.1965 numMergedOcc 0
3 mol 34 unq 2 iso 0 dist 8.6127 9.25005 4.74094 11.3171 8.61637 13.2424 numMergedOcc 0
4 mol 34 unq 3 iso 0 dist 9.25005 8.6127 4.74094 5.08831 9.95093 8.0991 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 5.92771 9.942 14.4922 6.92761 5.53419 14.4898 numMergedOcc 0
6 mol 83 unq 0 iso 0 dist 6.72584 7.25594 5.72008 11.4378 8.99451 14.5056 numMergedOcc 0
7 mol 153 unq 0 iso 0 dist 5.17415 8.379 5.1218 5.84134 7.97325 12.3934 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 4.88625 4.80508 3.19759 7.33177 7.20362 9.28176 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 6.24232 6.13116 5.29906 12.3252 6.12453 9.87447 numMergedOcc 0
10 mol 168 unq 1 iso 0 dist 8.1953 8.16253 5.29906 7.48749 6.12453 9.87447 numMergedOcc 0
11 mol 168 unq 2 iso 0 dist 6.13116 6.24232 5.29906 12.3252 9.87447 6.12453 numMergedOcc 0
12 mol 168 unq 3 iso 0 dist 8.16253 8.1953 5.29906 7.48749 9.87447 6.12453 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 9.03941 8.69094 5.75027 12.1927 7.85698 13.1429 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 9.03941 8.69094 5.75027 11.6241 6.35799 11.9608 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 9.11936 9.35481 10.9743 5.71349 9.62748 14.5294 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 9.11936 8.20517 8.05894 5.71349 9.62748 5.12964 numMergedOcc 0
17 mol 184 unq 2 iso 0 dist 8.20517 9.35481 14.6266 5.71349 5.12964 14.5294 numMergedOcc 0
18 mol 184 unq 3 iso 0 dist 8.20517 9.11936 8.05894 5.71349 5.12964 9.62748 numMergedOcc 0
19 mol 184 unq 4 iso 0 dist 9.15923 7.79098 8.04915 12.9618 5.12964 12.4906 numMergedOcc 0
20 mol 184 unq 5 iso 0 dist 7.79098 9.15923 8.04915 6.2568 7.02762 13.0767 numMergedOcc 0
21 mol 184 unq 6 iso 0 dist 6.03505 6.30144 8.04915 8.54538 5.12964 12.4906 numMergedOcc 0
22 mol 184 unq 7 iso 0 dist 6.30144 6.03505 8.04915 9.41221 7.02762 13.0767 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 6.23874 6.68956 4.68872 5.48793 9.23152 9.92791 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 6.23874 6.68956 4.68872 5.48793 9.23152 9.92791 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 6.23874 6.68956 4.68872 5.48793 9.23152 9.92791 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 5.00754 6.70519 4.59062 5.85169 9.01437 9.93413 numMergedOcc 0
