0 mol 37 unq 0 iso 0 dist 9.25986 7.65802 9.16636 8.50293 10.3295 7.14868 7.86222 7.63645 10.14 14.0819 numMergedOcc 0
1 mol 37 unq 1 iso 0 dist 9.25986 7.65802 9.16636 8.82649 4.68181 5.58769 7.86222 7.63645 10.14 7.17699 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.01454 9.53081 5.41488 8.80334 13.7656 16.9756 4.16088 9.18584 12.851 9.54797 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 7.24183 5.41357 7.05519 8.64746 5.78769 4.97497 6.10515 9.14856 7.7933 8.4517 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 7.24183 5.41357 7.05519 8.64746 5.78769 4.97497 8.70732 4.97843 11.058 10.2507 numMergedOcc 0
5 mol 64 unq 2 iso 0 dist 7.24183 9.30042 8.49962 8.64746 5.78769 6.60091 6.10515 9.14856 12.4521 8.4517 numMergedOcc 0
6 mol 64 unq 3 iso 0 dist 7.24183 9.30042 8.49962 8.64746 5.78769 6.60091 8.70732 4.97843 13.1776 10.2507 numMergedOcc 0
7 mol 99 unq 0 iso 0 dist 6.81741 8.68674 4.74328 9.46619 5.17028 6.83905 7.35957 8.15733 11.2459 6.6925 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 7.57716 6.50756 8.34243 9.49722 12.5157 7.8513 6.68039 9.55672 12.4163 12.2763 numMergedOcc 0
9 mol 224 unq 0 iso 0 dist 7.58998 6.23677 6.88745 8.76325 9.57742 4.76056 4.10214 4.64336 7.49889 10.1323 numMergedOcc 0
10 mol 226 unq 0 iso 0 dist 7.20862 8.74399 12.3908 7.45381 6.05562 12.3027 7.32691 6.44662 10.6648 11.3083 numMergedOcc 0
11 mol 258 unq 0 iso 0 dist 8.97411 8.58092 13.2474 6.73928 5.28906 11.8838 6.42545 9.09553 14.9076 7.16259 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 8.42706 8.8646 3.93133 5.45375 10.3992 8.73313 8.29194 6.36049 9.80699 12.9239 numMergedOcc 0
13 mol 266 unq 1 iso 0 dist 8.42706 8.8646 3.93133 5.45375 10.3992 8.73313 14.5478 9.19928 12.5239 18.5017 numMergedOcc 0
14 mol 266 unq 2 iso 0 dist 8.42706 8.8646 3.93133 9.9145 15.5784 13.3737 8.29194 6.36049 9.80699 17.4187 numMergedOcc 0
15 mol 266 unq 3 iso 0 dist 8.42706 8.8646 3.93133 9.9145 15.5784 13.3737 14.5478 9.19928 12.5239 22.5359 numMergedOcc 0
16 mol 293 unq 0 iso 0 dist 8.8788 4.72125 8.14268 5.50284 7.15032 5.86908 7.77971 7.96687 10.6115 10.055 numMergedOcc 0
17 mol 293 unq 1 iso 0 dist 8.8788 4.72125 8.14268 8.88355 4.91842 10.4612 7.77971 7.96687 10.6115 6.33356 numMergedOcc 0
