0 mol 26 unq 0 iso 0 dist 8.6112 6.88695 4.09495 7.89667 7.07479 8.39015 5.3315 10.8071 8.34347 8.31381 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 5.81747 9.59244 10.6918 4.90216 4.82623 11.6713 10.9658 9.00229 19.1676 8.30217 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 6.81975 9.59244 7.5168 4.90216 6.24283 11.6713 10.9658 12.5405 19.1676 8.30217 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 9.64281 8.89481 14.0364 9.86767 3.77247 13.0914 4.36935 10.783 5.86073 9.59585 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 8.43293 7.04864 5.89379 8.03124 3.71884 3.35803 6.81949 11.2107 6.44653 8.38358 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 7.12336 9.50322 6.26797 8.52036 5.56456 10.3893 16.4238 10.0854 14.52 9.72387 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 7.12336 5.82404 9.73435 8.52036 5.56456 11.323 16.4238 10.0854 19.4593 9.72387 numMergedOcc 0
7 mol 183 unq 0 iso 0 dist 5.44125 5.83071 4.81807 5.50896 6.58331 4.62251 9.42381 12.8756 13.1843 9.1139 numMergedOcc 0
8 mol 183 unq 1 iso 0 dist 5.44125 7.07224 10.0008 5.50896 6.58331 4.68341 9.42381 12.8756 10.4574 9.1139 numMergedOcc 0
9 mol 183 unq 2 iso 0 dist 5.44125 9.82101 11.2316 5.50896 6.58331 9.83938 9.42381 12.8756 17.0049 9.1139 numMergedOcc 0
10 mol 183 unq 3 iso 0 dist 7.11505 5.83071 5.92045 5.50896 5.46887 4.62251 9.42381 11.6186 13.1843 9.1139 numMergedOcc 0
11 mol 183 unq 4 iso 0 dist 7.11505 7.07224 9.95614 5.50896 5.46887 4.68341 9.42381 11.6186 10.4574 9.1139 numMergedOcc 0
12 mol 183 unq 5 iso 0 dist 7.11505 9.82101 12.9864 5.50896 5.46887 9.83938 9.42381 11.6186 17.0049 9.1139 numMergedOcc 0
13 mol 183 unq 6 iso 0 dist 8.7143 5.83071 7.68618 5.50896 11.1045 4.62251 9.42381 17.4464 13.1843 9.1139 numMergedOcc 0
14 mol 183 unq 7 iso 0 dist 8.7143 7.07224 9.81623 5.50896 11.1045 4.68341 9.42381 17.4464 10.4574 9.1139 numMergedOcc 0
15 mol 183 unq 8 iso 0 dist 8.7143 9.82101 4.73001 5.50896 11.1045 9.83938 9.42381 17.4464 17.0049 9.1139 numMergedOcc 0
16 mol 196 unq 0 iso 0 dist 7.556 9.99314 4.59462 6.10505 7.96489 10.3492 4.57882 6.25429 10.1741 4.67869 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 9.718 8.62103 14.2438 9.25184 12.162 4.29623 3.84723 11.8313 6.18308 6.85824 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 8.61629 8.62103 11.4281 9.25184 9.9492 4.29623 3.84723 10.4825 6.18308 6.85824 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 8.92054 8.48065 6.84447 8.1174 3.76405 4.75609 5.23741 9.11256 5.4638 8.08965 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 5.30455 6.42725 5.59901 6.69951 9.58753 5.97386 8.70769 9.12507 5.30224 8.25897 numMergedOcc 0
21 mol 259 unq 1 iso 0 dist 6.8184 6.42725 4.30432 6.69951 6.78897 5.97386 8.70769 9.57887 5.30224 8.25897 numMergedOcc 0
