0 mol 17 unq 0 iso 0 dist 5.84559 8.35273 11.7258 9.34439 14.5409 8.62221 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 6.48849 9.04157 11.5469 6.99048 10.6513 5.03451 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 7.61643 5.98169 5.34746 7.09127 9.77881 4.49593 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 8.48238 8.35776 4.52962 8.41022 11.925 9.2795 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 6.64844 8.13664 6.81182 11.8465 7.998 5.92771 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.9259 9.85185 4.56304 6.05632 7.75977 6.51132 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 6.35449 6.91039 3.66518 14.6524 10.8089 7.99127 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 8.99568 5.55632 4.75232 6.8798 8.10747 8.12953 numMergedOcc 0
8 mol 212 unq 0 iso 0 dist 8.48834 9.67805 4.18876 6.82049 10.9992 9.27163 numMergedOcc 0
9 mol 249 unq 0 iso 0 dist 6.88579 5.3865 4.49386 4.20982 8.9309 6.32658 numMergedOcc 0
10 mol 249 unq 1 iso 0 dist 7.30848 5.3865 5.33399 4.20982 10.1294 6.32658 numMergedOcc 0
11 mol 257 unq 0 iso 0 dist 8.68995 8.71617 13.4601 11.4751 18.1148 6.19418 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 8.67835 6.02628 13.0341 7.94428 16.3813 8.56451 numMergedOcc 0
13 mol 272 unq 0 iso 0 dist 8.38819 7.08918 8.31208 6.36261 13.7992 8.3872 numMergedOcc 0
