0 mol 5 unq 0 iso 0 dist 8.70824 5.2392 11.3755 11.97 9.17088 15.2214 numMergedOcc 0
1 mol 81 unq 0 iso 0 dist 8.9672 5.73799 3.82386 5.65355 9.48146 7.07095 numMergedOcc 0
2 mol 81 unq 1 iso 0 dist 8.9672 8.38883 11.9686 5.65355 9.48146 13.9075 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 5.73946 6.31773 5.34438 6.75472 7.9258 10.5599 numMergedOcc 0
4 mol 129 unq 0 iso 0 dist 5.16531 6.53559 9.54936 10.0961 8.59695 11.7541 numMergedOcc 0
5 mol 129 unq 1 iso 0 dist 5.16531 7.90844 9.63929 10.0961 8.59695 17.1791 numMergedOcc 0
6 mol 129 unq 2 iso 0 dist 6.65878 8.09774 6.31483 5.56946 8.00624 5.51197 numMergedOcc 0
7 mol 129 unq 3 iso 0 dist 6.65878 8.09774 6.31483 6.10584 8.42289 12.8996 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 8.65008 5.06116 7.59527 5.5065 6.36439 8.33439 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 9.35664 9.48766 6.04748 8.95444 7.04524 11.8893 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 7.32228 6.0033 6.57766 7.56497 8.67786 9.10817 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 9.85777 6.41148 6.16492 4.2475 6.94789 6.49765 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 5.05912 6.41148 9.99561 4.2475 6.23932 6.49765 numMergedOcc 0
13 mol 205 unq 2 iso 0 dist 6.60429 5.06713 9.99561 6.8901 6.23932 6.49765 numMergedOcc 0
14 mol 205 unq 3 iso 0 dist 6.60429 8.69512 15.2328 6.8901 6.23932 14.2129 numMergedOcc 0
15 mol 212 unq 0 iso 0 dist 8.09185 5.03184 7.52135 6.89695 9.55058 9.09874 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 8.01777 8.7831 12.6648 6.52848 7.41931 14.3009 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 8.01777 9.61071 13.8023 6.52848 7.41931 14.2 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 8.01777 7.1229 8.98854 6.52848 7.41931 8.51625 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 6.94194 8.58772 4.55363 4.71394 6.43046 10.1703 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 6.74849 9.22764 4.55363 4.3282 6.43046 10.1703 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 5.83514 6.96382 4.70535 5.65577 4.80834 8.923 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 4.53228 7.96523 7.26668 8.37622 7.78671 13.6089 numMergedOcc 0
