0 mol 12 unq 0 iso 0 dist 9.99955 6.6051 11.9718 6.98179 10.0509 9.75368 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 9.78092 8.15864 11.9718 6.9065 10.0509 9.75368 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.58581 5.85737 5.75364 6.88453 6.85331 8.0319 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 7.99091 7.44828 9.147 5.7655 11.101 9.79966 numMergedOcc 0
4 mol 33 unq 1 iso 0 dist 7.99091 7.44828 9.147 5.62472 5.66319 5.52992 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 9.79678 8.84944 4.22382 7.95485 12.8044 9.21978 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 9.79678 8.84944 4.22382 14.9082 10.9455 8.03754 numMergedOcc 0
7 mol 43 unq 2 iso 0 dist 6.76674 7.32913 7.71041 6.9067 9.08164 9.47348 numMergedOcc 0
8 mol 66 unq 0 iso 0 dist 9.03383 8.68658 14.4123 11.4986 18.7464 7.3359 numMergedOcc 0
9 mol 69 unq 0 iso 0 dist 7.98408 9.32184 7.91431 7.88096 12.0691 7.25721 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 7.45114 9.52061 15.8255 5.99695 11.0507 8.59695 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 9.08036 9.19171 13.8836 10.4466 18.3563 8.88233 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 7.4963 8.8353 5.25819 17.2988 12.7088 9.47554 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 9.35707 7.77669 6.00504 13.7353 14.1684 8.92292 numMergedOcc 0
14 mol 140 unq 1 iso 0 dist 9.35707 7.77669 6.00504 12.5321 9.41832 8.67876 numMergedOcc 0
15 mol 140 unq 2 iso 0 dist 9.35707 7.77669 6.00504 11.9489 5.44596 9.11235 numMergedOcc 0
16 mol 140 unq 3 iso 0 dist 9.35707 7.77669 6.00504 4.95731 9.69069 8.15118 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 9.38418 9.52029 17.6365 18.5654 26.8577 9.44947 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 8.37469 8.57174 6.77956 9.18635 10.2437 9.9693 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 9.31156 6.23677 6.16829 6.87755 4.79841 7.49783 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 5.22312 7.39596 5.39195 6.73193 10.6008 9.40032 numMergedOcc 0
21 mol 280 unq 0 iso 0 dist 6.88553 4.45141 4.68825 6.07005 9.26066 5.41639 numMergedOcc 0
22 mol 280 unq 1 iso 0 dist 6.88553 4.45141 4.68825 7.38048 12.5331 7.96485 numMergedOcc 0
23 mol 293 unq 0 iso 0 dist 9.15753 6.42608 11.0181 9.35524 16.2182 5.44043 numMergedOcc 0
