0 mol 5 unq 0 iso 0 dist 6.83131 9.81516 4.91617 9.17453 9.54819 14.2098 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 7.51584 6.17406 8.88528 7.84694 12.0574 3.91893 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 7.51584 8.64753 14.3158 7.84694 12.0574 4.94281 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 9.16277 8.91775 9.78887 6.31029 4.80844 7.06954 numMergedOcc 0
4 mol 162 unq 0 iso 0 dist 9.18446 8.01723 5.71752 9.39575 11.071 9.75769 numMergedOcc 0
5 mol 162 unq 1 iso 0 dist 9.18446 8.81613 7.64927 9.39575 11.071 4.2048 numMergedOcc 0
6 mol 169 unq 0 iso 0 dist 8.88798 8.28207 9.21253 7.47708 12.0405 11.1464 numMergedOcc 0
7 mol 169 unq 1 iso 0 dist 8.88798 8.37345 13.568 7.47708 12.0405 11.6489 numMergedOcc 0
8 mol 170 unq 0 iso 0 dist 6.79696 8.20406 7.29587 7.31063 11.2584 8.04307 numMergedOcc 0
9 mol 206 unq 0 iso 0 dist 6.81389 7.17033 10.6492 5.05188 7.13626 3.62998 numMergedOcc 0
10 mol 206 unq 1 iso 0 dist 6.81389 7.17033 10.6492 7.28682 12.033 6.00161 numMergedOcc 0
11 mol 206 unq 2 iso 0 dist 9.31865 7.17033 6.13428 5.05188 7.73698 3.62998 numMergedOcc 0
12 mol 206 unq 3 iso 0 dist 9.31865 7.17033 6.13428 7.28682 3.54356 6.00161 numMergedOcc 0
13 mol 237 unq 0 iso 0 dist 6.68833 8.20201 5.90415 8.5384 5.20161 5.18809 numMergedOcc 0
14 mol 237 unq 1 iso 0 dist 6.68833 6.21939 9.2471 8.5384 5.20161 9.41069 numMergedOcc 0
15 mol 237 unq 2 iso 0 dist 6.6655 8.08467 11.2776 8.96961 5.15592 10.3308 numMergedOcc 0
16 mol 237 unq 3 iso 0 dist 6.6655 7.00854 6.12402 8.96961 5.15592 5.74428 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.06516 6.85567 9.38172 5.4353 10.6586 12.0915 numMergedOcc 0
18 mol 270 unq 0 iso 0 dist 5.72325 8.93707 5.47584 7.37835 4.3429 9.56946 numMergedOcc 0
19 mol 270 unq 1 iso 0 dist 5.72325 8.93707 5.47584 4.62449 6.03752 6.72549 numMergedOcc 0
