0 mol 29 unq 0 iso 0 dist 8.60353 5.45544 8.97885 7.68854 5.01866 5.09702 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 8.95563 8.37969 6.97819 16.2033 12.6483 8.66724 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 6.59634 3.58984 6.97819 12.077 12.6483 8.66724 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 6.63043 7.81816 6.02168 10.4859 4.10656 8.92221 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 6.27123 10.6331 9.85856 12.8127 9.97735 8.92221 numMergedOcc 0
5 mol 64 unq 2 iso 0 dist 5.8333 8.87081 9.85856 13.5894 9.97735 8.92221 numMergedOcc 0
6 mol 64 unq 3 iso 0 dist 7.06708 14.7345 9.85856 17.0097 9.97735 8.92221 numMergedOcc 0
7 mol 66 unq 0 iso 0 dist 7.24524 9.62896 9.31667 17.0067 12.512 9.6145 numMergedOcc 0
8 mol 66 unq 1 iso 0 dist 7.24524 9.62896 9.31667 15.4321 10.573 8.32859 numMergedOcc 0
9 mol 66 unq 2 iso 0 dist 8.34154 11.8384 9.31667 12.4636 12.512 9.6145 numMergedOcc 0
10 mol 66 unq 3 iso 0 dist 8.34154 11.8384 9.31667 12.9996 10.573 8.32859 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 7.33482 4.41928 7.10479 9.9464 4.30303 8.16401 numMergedOcc 0
12 mol 107 unq 0 iso 0 dist 8.087 13.076 5.41377 9.68222 4.32384 6.11492 numMergedOcc 0
13 mol 157 unq 0 iso 0 dist 5.81566 7.50283 7.98849 14.2755 12.9885 8.40821 numMergedOcc 0
14 mol 157 unq 1 iso 0 dist 5.81566 7.50283 7.98849 12.9162 11.6191 9.86925 numMergedOcc 0
15 mol 170 unq 0 iso 0 dist 9.11865 9.82965 9.38182 14.6984 9.84933 8.75024 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 8.03228 6.31671 9.23008 10.2097 9.87705 5.03818 numMergedOcc 0
17 mol 205 unq 1 iso 0 dist 8.03228 6.31671 9.23008 5.63283 10.3551 6.40171 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 6.39655 6.86345 9.3174 11.8272 15.2922 9.95026 numMergedOcc 0
19 mol 206 unq 1 iso 0 dist 8.05723 16.7358 9.3174 21.3732 15.2922 9.95026 numMergedOcc 0
