0 mol 0 unq 0 iso 0 dist 8.99617 8.86609 11.2254 11.2001 9.19007 12.4853 18.0627 14.0232 18.2788 6.91778 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 5.87266 5.18338 4.3947 5.41626 7.05346 8.30653 11.2374 8.88528 10.6575 7.32257 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 5.78238 9.03541 7.56164 9.59761 6.60423 12.3058 16.7308 11.9395 18.0797 9.41441 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.59232 5.79157 5.56296 5.72472 5.16364 8.72682 11.7493 9.03289 13.952 6.02816 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.59232 7.91605 5.50891 5.72472 5.16364 5.61588 11.7493 9.03289 8.26195 6.02816 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 6.59232 6.43707 4.75954 5.72472 5.16364 7.83244 11.7493 9.03289 12.382 6.02816 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 8.98581 6.45477 3.75378 4.98373 7.63338 7.36975 10.8751 11.5146 12.207 7.78652 numMergedOcc 0
7 mol 143 unq 1 iso 0 dist 8.98581 6.45477 3.75378 4.98373 7.63338 7.36975 13.1013 13.434 14.7271 8.91301 numMergedOcc 0
8 mol 162 unq 0 iso 0 dist 7.34321 9.95076 13.4835 6.71523 8.00506 16.1559 9.25835 4.56165 16.3342 6.45896 numMergedOcc 0
9 mol 162 unq 1 iso 0 dist 7.34321 7.76112 11.1329 6.71523 8.00506 14.2948 9.25835 4.56165 14.6018 6.45896 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.51006 9.82338 8.58039 10.568 7.20574 6.61112 13.6647 11.8992 4.03697 8.73217 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 9.51006 7.99933 9.96652 10.568 7.20574 11.4283 13.6647 11.8992 8.99937 8.73217 numMergedOcc 0
12 mol 223 unq 0 iso 0 dist 6.82737 8.85178 4.40141 4.67731 6.13306 6.42257 6.64193 6.80048 10.5752 7.48463 numMergedOcc 0
13 mol 223 unq 1 iso 0 dist 6.82737 9.73123 9.63911 4.67731 6.13306 9.33543 6.64193 6.80048 3.86668 7.48463 numMergedOcc 0
14 mol 223 unq 2 iso 0 dist 6.80967 5.50267 4.40141 7.19485 6.13306 6.42257 11.867 6.80048 10.5752 7.48463 numMergedOcc 0
15 mol 232 unq 0 iso 0 dist 6.29118 9.11418 8.03712 4.90814 7.83711 6.71524 13.5442 13.8622 11.2243 9.05071 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 7.92537 5.60922 8.8725 9.73122 6.43341 10.0975 6.12347 5.89415 3.70525 9.09855 numMergedOcc 0
