0 mol 8 unq 0 iso 0 dist 8.68949 8.89145 13.2274 9.95165 11.3943 12.1308 9.31461 3.84732 11.4855 9.25055 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.68949 6.92865 8.33226 9.95165 11.3943 5.02333 9.31461 3.84732 5.96331 9.25055 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.75001 7.78708 5.18509 8.75332 9.99008 6.62608 9.97466 12.5764 8.32752 11.1564 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 8.75001 7.84393 12.48 8.75332 9.99008 6.49317 9.97466 12.5764 6.3033 11.1564 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.53081 5.36645 12.299 7.31914 8.84906 7.34452 5.43913 13.4515 3.63758 7.04689 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 9.53081 5.36645 12.299 7.31914 8.84906 7.34452 8.26877 17.6258 6.88863 12.5922 numMergedOcc 0
6 mol 124 unq 0 iso 0 dist 7.18976 7.23052 5.1738 4.83761 6.62221 9.70339 8.50362 5.3096 9.79481 5.46636 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 6.87456 5.30872 8.03483 8.07799 7.56937 3.86476 8.10681 3.9771 7.20921 5.15315 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 7.20545 8.58946 4.70374 9.69541 6.13084 10.3157 8.43955 6.87479 6.13061 8.88237 numMergedOcc 0
9 mol 214 unq 0 iso 0 dist 5.86911 9.4835 13.1789 8.67237 4.34898 15.3526 9.46274 14.085 4.15355 15.6339 numMergedOcc 0
10 mol 214 unq 1 iso 0 dist 5.86911 9.4835 13.1789 7.49436 9.85943 6.00534 9.46274 14.085 4.15355 5.92503 numMergedOcc 0
11 mol 214 unq 2 iso 0 dist 7.89258 9.4835 10.1543 8.67237 7.98253 15.3526 9.46274 12.4498 4.15355 15.6339 numMergedOcc 0
12 mol 214 unq 3 iso 0 dist 7.89258 9.4835 10.1543 7.49436 7.94395 6.00534 9.46274 12.4498 4.15355 5.92503 numMergedOcc 0
13 mol 274 unq 0 iso 0 dist 9.34051 9.81087 7.24261 9.4626 5.53273 7.52207 8.67957 4.66969 10.7853 8.96388 numMergedOcc 0
14 mol 279 unq 0 iso 0 dist 8.03486 6.47376 4.51031 7.5355 10.4013 6.15987 9.98182 5.04826 5.84996 11.5492 numMergedOcc 0
15 mol 284 unq 0 iso 0 dist 7.74965 8.08993 4.76222 5.68818 5.94174 6.4399 8.2236 11.8933 14.4667 9.00846 numMergedOcc 0
16 mol 284 unq 1 iso 0 dist 7.74965 7.34344 13.4636 5.68818 5.94174 13.016 8.2236 11.8933 12.4957 9.00846 numMergedOcc 0
