0 mol 5 unq 0 iso 0 dist 6.40459 5.04052 4.59167 8.94893 7.75279 11.0809 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.58084 8.87863 4.59167 11.5351 7.75279 11.0809 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.05327 6.56383 4.55422 8.70972 8.5859 7.95815 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 8.34435 7.12529 3.54989 14.0383 9.45622 12.5227 numMergedOcc 0
4 mol 56 unq 1 iso 0 dist 8.34435 8.4185 4.67834 14.0383 9.45622 6.54758 numMergedOcc 0
5 mol 56 unq 2 iso 0 dist 8.34435 8.65122 12.4373 14.0383 9.45622 15.029 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 8.09271 9.04548 8.48585 6.88345 8.41025 9.43916 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 8.41574 7.062 9.66553 13.1737 9.754 17.2115 numMergedOcc 0
8 mol 81 unq 1 iso 0 dist 8.41574 7.062 9.66553 6.35845 5.61263 11.3189 numMergedOcc 0
9 mol 86 unq 0 iso 0 dist 8.8236 7.19148 4.50855 7.90563 9.18511 6.56673 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 6.29879 7.09831 4.85121 10.9634 6.00667 10.1793 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 6.29879 7.09831 4.85121 10.7165 8.00919 12.0479 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 9.67331 8.61511 7.45747 6.72436 7.76297 11.7855 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 8.91834 9.23896 8.33923 9.7362 8.44627 13.9413 numMergedOcc 0
14 mol 148 unq 1 iso 0 dist 8.91834 6.02506 4.05566 9.7362 8.44627 9.93912 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 8.84061 9.46439 8.49102 9.86164 8.60168 14.303 numMergedOcc 0
16 mol 150 unq 1 iso 0 dist 8.84061 6.07854 3.92044 9.86164 8.60168 10.0745 numMergedOcc 0
17 mol 162 unq 0 iso 0 dist 8.80787 8.64101 12.2255 9.76402 8.73901 17.43 numMergedOcc 0
18 mol 184 unq 0 iso 0 dist 7.73442 9.53656 6.63015 14.7131 9.63728 14.9747 numMergedOcc 0
19 mol 184 unq 1 iso 0 dist 7.73442 7.06562 10.6362 14.7131 9.63728 18.862 numMergedOcc 0
20 mol 247 unq 0 iso 0 dist 6.63325 5.97717 3.42642 6.70994 6.32156 7.95874 numMergedOcc 0
21 mol 255 unq 0 iso 0 dist 8.01663 8.08403 8.06922 9.34243 9.35269 15.4229 numMergedOcc 0
