0 mol 9 unq 0 iso 0 dist 6.02191 10.1574 8.55446 9.41073 4.74921 5.40172 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.02191 10.5873 6.59455 9.41073 4.74921 3.91893 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 6.02191 11.7145 5.71201 9.41073 4.74921 4.94281 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 6.69917 7.11602 7.40415 4.20692 8.75468 10.4406 numMergedOcc 0
4 mol 28 unq 1 iso 0 dist 6.69917 7.11602 7.40415 6.88969 7.62989 12.0524 numMergedOcc 0
5 mol 28 unq 2 iso 0 dist 6.69917 7.11602 7.40415 10.3116 5.70238 10.0581 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 8.64844 5.08831 6.15801 10.7132 9.31883 9.92713 numMergedOcc 0
7 mol 34 unq 1 iso 0 dist 8.64844 5.08831 6.15801 12.8676 9.475 10.6518 numMergedOcc 0
8 mol 34 unq 2 iso 0 dist 8.64844 5.08831 6.15801 8.77785 8.34011 5.94977 numMergedOcc 0
9 mol 34 unq 3 iso 0 dist 8.64844 5.08831 6.15801 9.16728 6.29842 6.35031 numMergedOcc 0
10 mol 34 unq 4 iso 0 dist 8.64844 6.54316 9.63403 10.7132 9.31883 15.7295 numMergedOcc 0
11 mol 34 unq 5 iso 0 dist 8.64844 6.54316 9.63403 12.8676 9.475 16.8534 numMergedOcc 0
12 mol 34 unq 6 iso 0 dist 8.64844 6.54316 9.63403 8.77785 8.34011 12.3865 numMergedOcc 0
13 mol 34 unq 7 iso 0 dist 8.64844 6.54316 9.63403 9.16728 6.29842 5.50427 numMergedOcc 0
14 mol 34 unq 8 iso 0 dist 8.64844 13.7964 8.07314 10.7132 9.31883 16.4972 numMergedOcc 0
15 mol 34 unq 9 iso 0 dist 8.64844 13.7964 8.07314 12.8676 9.475 15.5365 numMergedOcc 0
16 mol 34 unq 10 iso 0 dist 8.64844 13.7964 8.07314 8.77785 8.34011 13.3825 numMergedOcc 0
17 mol 34 unq 11 iso 0 dist 8.64844 13.7964 8.07314 9.16728 6.29842 5.12822 numMergedOcc 0
18 mol 60 unq 0 iso 0 dist 8.04921 3.80331 4.65127 6.17084 6.46718 3.99942 numMergedOcc 0
19 mol 73 unq 0 iso 0 dist 9.26179 5.18957 7.62738 11.7078 8.59337 12.1293 numMergedOcc 0
20 mol 73 unq 1 iso 0 dist 9.26179 5.18957 7.62738 16.0942 7.66942 15.0139 numMergedOcc 0
21 mol 143 unq 0 iso 0 dist 7.52352 10.4027 6.95372 9.72694 8.56866 6.36052 numMergedOcc 0
22 mol 143 unq 1 iso 0 dist 7.52352 10.4027 6.95372 10.7652 5.66207 4.5497 numMergedOcc 0
23 mol 143 unq 2 iso 0 dist 7.23619 8.25297 6.95372 9.96149 8.56866 6.36052 numMergedOcc 0
24 mol 143 unq 3 iso 0 dist 7.23619 8.25297 6.95372 7.81193 5.66207 4.5497 numMergedOcc 0
25 mol 151 unq 0 iso 0 dist 8.40211 9.16226 4.74531 15.6052 9.06016 11.8889 numMergedOcc 0
26 mol 151 unq 1 iso 0 dist 8.24746 10.6214 4.74531 13.0205 9.06016 11.8889 numMergedOcc 0
27 mol 158 unq 0 iso 0 dist 8.15524 13.3358 6.76055 10.7405 8.06621 9.64397 numMergedOcc 0
28 mol 158 unq 1 iso 0 dist 8.15524 14.2466 9.36343 10.7405 8.06621 5.16839 numMergedOcc 0
29 mol 163 unq 0 iso 0 dist 7.64106 10.013 9.79069 3.76674 7.69757 6.5925 numMergedOcc 0
30 mol 163 unq 1 iso 0 dist 7.64106 16.2291 9.27496 3.76674 7.69757 15.5126 numMergedOcc 0
31 mol 182 unq 0 iso 0 dist 7.60057 6.00841 8.43933 9.03379 9.19506 11.8933 numMergedOcc 0
32 mol 182 unq 1 iso 0 dist 7.60057 6.00841 8.43933 10.1184 9.94904 7.36876 numMergedOcc 0
33 mol 182 unq 2 iso 0 dist 7.60057 6.00841 8.43933 9.8017 9.30893 4.17332 numMergedOcc 0
34 mol 194 unq 0 iso 0 dist 6.56609 8.86184 7.74683 12.946 8.95728 8.24055 numMergedOcc 0
35 mol 205 unq 0 iso 0 dist 8.01082 10.038 9.17946 9.97098 5.19567 13.6793 numMergedOcc 0
36 mol 213 unq 0 iso 0 dist 9.95628 13.2163 8.42053 12.0117 7.79105 4.40538 numMergedOcc 0
37 mol 277 unq 0 iso 0 dist 7.2551 6.74507 8.81717 7.03845 4.61089 11.6159 numMergedOcc 0
