0 mol 0 unq 0 iso 0 dist 8.31596 7.48645 12.5081 6.0597 13.1109 6.64713 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 8 unq 0 iso 0 dist 6.26865 9.07858 11.705 16.8602 20.3264 8.77457 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 7.2199 9.82483 6.81435 6.0397 9.57198 8.076 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 6.9513 9.82483 12.6271 6.0397 12.164 8.076 numMergedOcc 0
5 mol 9 unq 2 iso 0 dist 9.16116 9.82483 17.0455 6.0397 14.1469 8.076 numMergedOcc 0
6 mol 9 unq 3 iso 0 dist 8.47109 9.82483 10.0146 6.0397 10.1029 8.076 numMergedOcc 0
7 mol 9 unq 4 iso 0 dist 8.47109 7.25684 4.71922 5.77558 12.1403 9.3523 numMergedOcc 0
8 mol 34 unq 0 iso 0 dist 7.71914 6.93364 6.51847 6.45654 8.2946 6.15801 numMergedOcc 0
9 mol 34 unq 1 iso 0 dist 7.71914 6.93364 6.51847 11.9626 9.25346 9.63403 numMergedOcc 0
10 mol 34 unq 2 iso 0 dist 7.71914 6.93364 6.51847 14.1223 13.1502 8.07314 numMergedOcc 0
11 mol 45 unq 0 iso 0 dist 8.13782 7.95778 4.52443 6.39184 5.55096 8.80014 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 9.86739 8.11094 7.70536 6.76585 8.809 9.17466 numMergedOcc 0
13 mol 114 unq 1 iso 0 dist 9.86739 8.06525 8.36453 9.47219 9.83981 9.35942 numMergedOcc 0
14 mol 114 unq 2 iso 0 dist 9.49413 8.06525 6.18257 9.47219 6.51395 9.35942 numMergedOcc 0
15 mol 114 unq 3 iso 0 dist 8.39249 8.11094 4.69847 6.76585 5.79343 9.17466 numMergedOcc 0
16 mol 114 unq 4 iso 0 dist 8.93623 8.11094 5.83121 6.76585 13.2529 9.17466 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 6.98849 7.59814 9.24851 6.15037 6.87262 7.82544 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 6.98849 9.7775 6.19569 6.15037 6.87262 6.18808 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 4.79852 7.01126 5.95187 4.30489 5.4997 5.89564 numMergedOcc 0
20 mol 175 unq 1 iso 0 dist 4.79852 7.01126 5.95187 4.57622 6.99693 5.60528 numMergedOcc 0
21 mol 175 unq 2 iso 0 dist 4.79852 6.58434 5.46129 4.57622 6.99693 5.5995 numMergedOcc 0
22 mol 213 unq 0 iso 0 dist 6.17451 7.37935 10.7667 9.84448 15.7816 8.42053 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 8.57853 6.61099 5.84583 6.65167 12.6911 8.3087 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 6.75035 6.61099 8.21424 6.65167 12.6212 8.3087 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 8.75834 5.13453 7.15437 6.16433 13.124 8.20162 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 7.51827 7.29542 8.99405 9.51752 14.999 9.23935 numMergedOcc 0
27 mol 225 unq 2 iso 0 dist 7.51827 7.29542 8.99405 10.9596 15.6422 7.77552 numMergedOcc 0
28 mol 225 unq 3 iso 0 dist 7.51827 5.13453 7.13893 6.16433 7.73748 8.20162 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 9.6101 9.06084 9.66782 6.56416 9.28101 6.00582 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 5.32183 9.06084 5.3976 6.56416 7.22019 6.00582 numMergedOcc 0
31 mol 239 unq 0 iso 0 dist 6.34801 7.18771 10.151 5.2908 10.9156 5.0804 numMergedOcc 0
32 mol 243 unq 0 iso 0 dist 9.1101 6.01071 8.16841 4.78857 7.12785 7.44706 numMergedOcc 0
33 mol 243 unq 1 iso 0 dist 8.93338 6.01071 6.03041 4.78857 6.66959 7.44706 numMergedOcc 0
34 mol 250 unq 0 iso 0 dist 8.16469 9.03319 7.62569 4.45194 6.28538 5.93798 numMergedOcc 0
35 mol 250 unq 1 iso 0 dist 9.88279 9.03319 13.3093 4.45194 10.8727 5.93798 numMergedOcc 0
36 mol 286 unq 0 iso 0 dist 8.81794 8.72146 16.0782 5.86348 14.39 8.69826 numMergedOcc 0
