0 mol 42 unq 0 iso 0 dist 9.82536 7.17806 6.14934 7.73997 4.50835 8.03678 numMergedOcc 0
1 mol 42 unq 1 iso 0 dist 9.82536 7.2023 8.64833 7.73997 4.50835 8.7885 numMergedOcc 0
2 mol 42 unq 2 iso 0 dist 8.77998 7.17806 8.04675 7.73997 4.98339 8.03678 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 8.37969 6.09371 8.2513 12.4652 16.0486 9.942 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 8.37969 6.09371 8.2513 10.9204 9.26597 5.92771 numMergedOcc 0
5 mol 63 unq 0 iso 0 dist 8.74231 8.11469 9.84668 11.0197 6.91113 6.0662 numMergedOcc 0
6 mol 63 unq 1 iso 0 dist 8.52783 11.1873 9.84668 11.1333 6.91113 6.0662 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 9.60879 5.29324 6.27528 11.6589 5.54818 7.07055 numMergedOcc 0
8 mol 69 unq 1 iso 0 dist 9.61096 6.25645 6.27528 10.1996 5.54818 7.07055 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 9.03233 6.47184 6.7319 5.24882 10.9086 8.72521 numMergedOcc 0
10 mol 143 unq 1 iso 0 dist 9.03233 6.47184 6.7319 13.5058 7.02542 8.19373 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 9.84636 6.38251 4.96326 12.4834 5.02061 7.02812 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 6.32172 9.96767 6.31492 16.7739 11.1685 8.43599 numMergedOcc 0
13 mol 182 unq 1 iso 0 dist 6.32172 10.2412 7.8621 10.863 6.1548 7.01577 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 9.65951 9.46843 7.92766 11.3197 6.49075 7.8518 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 9.14829 14.3686 7.92766 12.5386 6.49075 7.8518 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 8.67044 6.76595 4.71403 10.3444 5.99437 6.19516 numMergedOcc 0
17 mol 249 unq 0 iso 0 dist 9.0157 4.20982 6.93507 5.3865 5.57138 6.32658 numMergedOcc 0
18 mol 249 unq 1 iso 0 dist 9.14351 4.20982 6.42827 5.3865 10.3504 6.32658 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 9.75753 15.0104 5.76077 16.3659 9.46115 8.86676 numMergedOcc 0
