0 mol 34 unq 0 iso 0 dist 7.16143 5.47143 8.68012 11.2958 9.99145 13.2059 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 8.53522 4.8523 5.52834 13.9872 9.39402 10.1829 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.70465 6.15303 7.45777 11.4576 5.88827 7.85784 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.70465 6.15303 7.45777 17.9856 9.66175 14.3054 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 6.53252 5.55937 6.54194 4.9102 6.13394 3.74336 numMergedOcc 0
5 mol 158 unq 0 iso 0 dist 8.57243 11.0811 9.96635 11.069 7.76952 13.4119 numMergedOcc 0
6 mol 158 unq 1 iso 0 dist 8.57243 11.0811 9.96635 9.97778 9.98554 12.6695 numMergedOcc 0
7 mol 165 unq 0 iso 0 dist 5.81507 4.49675 5.99596 11.6081 9.54118 8.9387 numMergedOcc 0
8 mol 182 unq 0 iso 0 dist 8.40125 6.98552 8.27913 6.13655 9.75791 5.28013 numMergedOcc 0
9 mol 182 unq 1 iso 0 dist 8.40125 6.98552 8.27913 5.856 7.52751 11.1857 numMergedOcc 0
10 mol 182 unq 2 iso 0 dist 8.40125 6.02785 8.85111 6.13655 9.75791 5.89583 numMergedOcc 0
11 mol 182 unq 3 iso 0 dist 8.40125 6.02785 8.85111 5.856 7.52751 5.07242 numMergedOcc 0
12 mol 182 unq 4 iso 0 dist 8.40125 7.40718 6.38335 6.13655 9.75791 12.2157 numMergedOcc 0
13 mol 182 unq 5 iso 0 dist 8.40125 7.40718 6.38335 5.856 7.52751 5.36021 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 7.74764 6.46011 6.72718 4.92125 8.92335 8.09407 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.83755 8.77825 4.36421 13.9779 9.96715 9.91172 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 9.17075 13.8167 9.0836 6.80038 6.39822 7.52317 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 9.17075 13.8167 9.0836 4.5731 5.36518 9.52953 numMergedOcc 0
18 mol 266 unq 2 iso 0 dist 7.68224 10.5649 9.0836 12.6856 6.39822 7.52317 numMergedOcc 0
19 mol 266 unq 3 iso 0 dist 7.68224 10.5649 9.0836 12.0551 5.36518 9.52953 numMergedOcc 0
20 mol 266 unq 4 iso 0 dist 9.8751 10.5649 9.62494 14.936 9.90506 5.79323 numMergedOcc 0
21 mol 266 unq 5 iso 0 dist 9.8751 10.5649 9.62494 12.6856 8.61077 7.52317 numMergedOcc 0
22 mol 266 unq 6 iso 0 dist 9.8751 10.5649 9.62494 12.0551 9.11585 9.52953 numMergedOcc 0
23 mol 271 unq 0 iso 0 dist 6.56531 10.9694 9.50884 9.42579 9.97897 12.9579 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 8.90911 8.3109 6.66936 17.5861 9.07744 14.4215 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 8.90911 16.7779 8.15119 17.5861 9.07744 5.11865 numMergedOcc 0
26 mol 281 unq 0 iso 0 dist 5.84757 4.93146 6.58925 10.8706 9.39268 14.7035 numMergedOcc 0
27 mol 281 unq 1 iso 0 dist 5.0007 8.1531 6.58925 7.60311 9.39268 14.7035 numMergedOcc 0
