0 mol 14 unq 0 iso 0 dist 9.24546 10.495 7.59564 17.005 8.47263 9.42387 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 9.24546 10.495 7.59564 7.79091 5.82278 8.10957 numMergedOcc 0
2 mol 14 unq 2 iso 0 dist 7.79091 10.495 8.10957 17.005 11.5533 9.42387 numMergedOcc 0
3 mol 14 unq 3 iso 0 dist 7.79091 10.495 8.10957 9.24546 5.82278 7.59564 numMergedOcc 0
4 mol 17 unq 0 iso 0 dist 7.96836 5.21083 7.34681 10.5316 11.0023 9.5937 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 7.4343 6.39142 5.35252 10.7473 5.43494 9.40644 numMergedOcc 0
6 mol 87 unq 0 iso 0 dist 9.99609 12.809 9.90256 15.4998 10.445 5.63748 numMergedOcc 0
7 mol 87 unq 1 iso 0 dist 4.58684 5.79354 6.22441 6.90348 5.78586 5.91543 numMergedOcc 0
8 mol 87 unq 2 iso 0 dist 6.90348 5.79354 5.91543 4.58684 5.78586 6.22441 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 7.68908 5.56761 8.078 10.7434 11.6637 6.56481 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 9.09071 5.73517 6.53824 7.7367 4.48374 6.61973 numMergedOcc 0
11 mol 116 unq 1 iso 0 dist 7.7367 5.73517 6.61973 9.09071 4.48374 6.53824 numMergedOcc 0
12 mol 159 unq 0 iso 0 dist 9.5915 9.65752 9.9368 18.4986 14.3749 9.54337 numMergedOcc 0
13 mol 159 unq 1 iso 0 dist 9.5915 9.65752 9.9368 11.3065 4.82545 6.86212 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 7.21606 13.2658 9.40718 16.1051 12.0946 8.92801 numMergedOcc 0
15 mol 187 unq 0 iso 0 dist 9.90752 9.38569 8.0501 14.8352 11.6883 5.58167 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 7.52692 5.5367 6.20044 11.7737 6.2357 8.41232 numMergedOcc 0
17 mol 204 unq 1 iso 0 dist 9.7707 9.42629 6.20044 13.4764 6.2357 8.41232 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 7.58632 5.53796 5.86911 11.4352 5.68826 7.89258 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 9.92349 11.12 5.25149 9.70779 11.0459 8.6368 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 9.70779 11.12 8.6368 9.92349 11.0459 5.25149 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 6.55222 13.0572 8.86185 17.4366 15.9311 9.01071 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 7.32876 9.77666 8.57274 15.4695 10.4538 9.48772 numMergedOcc 0
23 mol 258 unq 1 iso 0 dist 7.32876 9.77666 8.57274 11.5351 6.94631 5.53369 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 9.40407 9.16384 8.40726 10.7644 7.06161 5.15923 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 9.40407 9.16384 8.40726 10.7644 7.06161 5.15923 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 9.40407 9.16384 8.40726 10.7644 7.06161 5.15923 numMergedOcc 0
