0 mol 8 unq 0 iso 0 dist 9.59644 10.0118 5.46588 12.4886 4.77791 8.70858 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 8.45063 5.14132 6.59367 6.91278 14.4796 9.22814 numMergedOcc 0
2 mol 75 unq 0 iso 0 dist 5.01633 8.91765 8.26819 9.01568 5.19081 9.24433 numMergedOcc 0
3 mol 116 unq 0 iso 0 dist 7.67429 4.6158 9.66069 9.62357 6.42183 8.31955 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 5.9962 11.4175 6.61636 12.2067 8.13581 7.46812 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 8.61448 6.2062 6.61636 5.84909 8.13581 7.46812 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 9.21476 5.81847 9.6818 5.47265 9.82809 9.80032 numMergedOcc 0
7 mol 173 unq 0 iso 0 dist 6.7407 10.5012 7.33162 11.5856 5.19052 9.71921 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 5.31333 9.58526 5.80433 6.36789 3.82682 7.46024 numMergedOcc 0
9 mol 217 unq 0 iso 0 dist 8.80103 9.52898 7.89936 7.81825 3.6199 8.94871 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 6.87565 5.19341 5.64376 8.39315 4.40152 7.6416 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 9.26313 4.52208 9.88216 12.289 13.774 9.53123 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 8.55211 10.3966 7.58405 12.8526 6.36561 5.85173 numMergedOcc 0
13 mol 260 unq 1 iso 0 dist 8.55211 5.51525 7.26115 12.8526 6.36561 8.66543 numMergedOcc 0
14 mol 293 unq 0 iso 0 dist 6.97887 11.0749 7.2668 17.0673 13.0731 9.94817 numMergedOcc 0
15 mol 293 unq 1 iso 0 dist 6.04186 11.0749 8.88355 17.0673 11.8274 9.94817 numMergedOcc 0
