0 mol 34 unq 0 iso 0 dist 9.44189 7.18022 7.31884 4.55481 6.74143 7.01952 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 9.44189 6.24711 4.38777 4.55481 6.74143 4.58552 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.92291 6.66407 10.0882 11.4153 18.7801 9.50614 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.92291 6.66407 10.0882 4.96926 10.5973 8.34145 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 9.43171 7.28228 7.53994 5.46827 11.1466 5.40489 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.43377 5.5087 4.25755 6.41115 11.6866 8.46627 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.43377 6.08682 6.08046 6.41115 11.6866 9.22208 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 6.50009 9.10524 4.20094 15.3018 11.4414 8.14226 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 8.65986 9.00918 15.3248 5.03507 11.4125 8.14226 numMergedOcc 0
9 mol 134 unq 2 iso 0 dist 8.65986 7.99477 15.8799 5.03507 11.4125 5.78982 numMergedOcc 0
10 mol 170 unq 0 iso 0 dist 6.36868 9.08274 5.40635 6.86812 6.92359 8.75024 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.47008 9.01624 8.25265 5.42158 13.0588 9.92831 numMergedOcc 0
12 mol 198 unq 0 iso 0 dist 5.82585 9.31526 5.02597 12.1607 12.6156 9.91727 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 9.88976 8.14831 17.2402 6.28241 15.272 6.46405 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 7.48753 8.19317 5.67913 9.72447 9.42129 6.03081 numMergedOcc 0
15 mol 235 unq 1 iso 0 dist 7.48753 8.19317 5.67913 12.983 12.8115 7.41433 numMergedOcc 0
16 mol 235 unq 2 iso 0 dist 7.48753 6.29377 4.80217 10.3462 13.1904 8.85214 numMergedOcc 0
17 mol 235 unq 3 iso 0 dist 7.48753 6.29377 4.80217 9.72447 9.42129 5.1874 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 8.29556 5.90924 4.46882 5.71153 10.8114 9.78237 numMergedOcc 0
19 mol 264 unq 1 iso 0 dist 8.29556 5.90924 4.46882 5.70542 13.3481 9.70101 numMergedOcc 0
20 mol 264 unq 2 iso 0 dist 8.29556 5.90924 4.46882 6.87635 12.6851 9.95798 numMergedOcc 0
21 mol 264 unq 3 iso 0 dist 8.47755 5.90058 4.46882 12.6872 10.8114 9.78237 numMergedOcc 0
22 mol 264 unq 4 iso 0 dist 8.47755 5.90058 4.46882 9.63145 13.3481 9.70101 numMergedOcc 0
23 mol 264 unq 5 iso 0 dist 8.47755 5.90058 4.46882 12.9337 12.6851 9.95798 numMergedOcc 0
