0 mol 111 unq 0 iso 0 dist 8.42147 7.22098 6.3561 10.3018 9.06601 13.9368 numMergedOcc 0
1 mol 111 unq 1 iso 0 dist 8.42147 7.22098 6.3561 4.88926 5.98809 7.24101 numMergedOcc 0
2 mol 124 unq 0 iso 0 dist 9.91381 7.46623 10.872 3.75669 8.57739 9.0745 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 8.54461 9.15278 7.93441 4.81304 8.81797 11.8119 numMergedOcc 0
4 mol 130 unq 1 iso 0 dist 8.54461 9.05561 7.0339 4.81304 8.81797 12.2896 numMergedOcc 0
5 mol 130 unq 2 iso 0 dist 7.83619 9.15278 14.308 4.81304 5.92733 11.8119 numMergedOcc 0
6 mol 130 unq 3 iso 0 dist 7.83619 9.05561 13.1903 4.81304 5.92733 12.2896 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 9.74498 9.61301 13.3193 6.37913 7.55419 9.981 numMergedOcc 0
8 mol 175 unq 0 iso 0 dist 9.57611 9.25721 3.98983 9.57126 9.32259 11.4625 numMergedOcc 0
9 mol 180 unq 0 iso 0 dist 8.44989 7.95427 3.5929 6.15473 9.63576 10.4564 numMergedOcc 0
10 mol 206 unq 0 iso 0 dist 8.31638 8.48679 6.13816 3.57449 9.4629 7.51798 numMergedOcc 0
11 mol 206 unq 1 iso 0 dist 9.72979 7.44186 6.13816 13.6373 9.4629 7.51798 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 9.67457 8.78286 17.8124 8.81074 6.85824 14.8027 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 9.59213 5.8374 9.17045 13.876 8.54108 12.6498 numMergedOcc 0
14 mol 283 unq 0 iso 0 dist 9.53225 5.7378 6.79513 7.27864 9.07995 9.74797 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 8.71213 8.45077 6.40962 3.97296 6.71946 7.8605 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 8.71213 8.45077 6.40962 11.6681 8.28061 14.0418 numMergedOcc 0
17 mol 285 unq 2 iso 0 dist 8.71213 8.45077 6.40962 10.6606 5.03601 10.4548 numMergedOcc 0
