0 mol 7 unq 0 iso 0 dist 8.33249 8.96896 8.0166 11.7898 6.0323 5.85668 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.34604 10.0019 9.67498 9.225 8.85869 10.2939 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.34604 8.96896 9.32945 9.225 8.85869 15.279 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.14422 8.96896 9.90117 9.225 7.5298 15.279 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 9.14422 8.96896 9.90117 14.3388 8.94874 11.7275 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.43675 8.40182 9.67498 3.87123 8.85869 10.2939 numMergedOcc 0
6 mol 7 unq 6 iso 0 dist 7.43675 15.7603 9.32945 3.87123 8.85869 15.279 numMergedOcc 0
7 mol 7 unq 7 iso 0 dist 7.7135 15.7603 9.90117 3.87123 7.5298 15.279 numMergedOcc 0
8 mol 7 unq 8 iso 0 dist 7.7135 15.7603 9.90117 15.7094 8.94874 11.7275 numMergedOcc 0
9 mol 61 unq 0 iso 0 dist 8.88571 10.925 4.628 8.75125 6.85094 4.71793 numMergedOcc 0
10 mol 61 unq 1 iso 0 dist 8.92623 8.22304 8.30431 12.3781 9.94756 16.966 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 7.76963 4.07128 7.02854 11.9775 7.71596 8.50377 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 9.84306 9.81052 6.21267 19.3099 9.81282 13.2623 numMergedOcc 0
13 mol 183 unq 1 iso 0 dist 9.84306 15.1597 7.41743 19.3099 9.81282 7.22697 numMergedOcc 0
14 mol 211 unq 0 iso 0 dist 7.79873 16.6888 9.8921 5.6174 7.15386 15.2751 numMergedOcc 0
15 mol 211 unq 1 iso 0 dist 7.79873 16.6888 9.8921 4.00712 7.73993 17.5039 numMergedOcc 0
16 mol 211 unq 2 iso 0 dist 7.79873 16.6888 9.8921 10.088 9.45365 16.4954 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 7.28604 11.6438 7.20862 9.41453 9.05082 15.6116 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 8.30861 12.4012 6.00654 7.12329 8.78008 10.1043 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 7.43195 5.41518 4.03921 6.98305 5.10595 5.46523 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 8.10271 9.74722 5.28417 5.68798 6.35457 5.08317 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 8.25521 9.85129 8.70702 5.43755 8.78148 8.66375 numMergedOcc 0
