0 mol 24 unq 0 iso 0 dist 8.52839 10.4706 9.58012 8.7263 11.8996 4.90592 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.52839 10.4706 9.58012 10.841 9.15493 8.16324 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 7.01303 7.6296 9.01011 12.5969 9.98219 8.29345 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 9.92785 11.8293 7.8674 16.8948 8.05783 7.62611 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 8.21739 3.74136 5.51624 7.29701 11.4196 7.62611 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 4.78377 3.74136 7.8674 7.29701 8.05783 7.62611 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 6.20301 8.69165 9.92553 8.82036 10.9279 6.76575 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 6.04112 5.44816 8.93453 10.6158 9.21506 9.78667 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 6.04112 5.44816 8.93453 6.93424 4.38393 6.73983 numMergedOcc 0
9 mol 141 unq 2 iso 0 dist 6.04112 5.44816 8.93453 6.8891 6.06881 7.64956 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 7.83509 4.52246 9.23528 9.52263 15.9875 7.25644 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 7.01483 5.88056 9.23528 12.6767 15.9875 7.25644 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 7.67051 6.25864 7.3546 10.8403 15.9955 9.79069 numMergedOcc 0
13 mol 163 unq 1 iso 0 dist 7.67051 6.25864 7.3546 10.3127 5.87447 9.27496 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 8.2866 6.71449 9.75627 13.2349 11.6944 8.1536 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 7.10883 8.96094 6.53728 15.6676 14.3973 9.23935 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 7.10883 8.96094 6.53728 15.6658 13.923 7.77552 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 9.27529 10.4532 8.55481 14.1491 12.0545 7.39391 numMergedOcc 0
