0 mol 12 unq 0 iso 0 dist 8.34132 8.3933 10.763 6.16894 8.98466 6.6051 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 8.34132 8.3933 10.763 5.93993 12.3593 8.15864 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 9.88657 9.36795 16.4149 12.9652 22.3251 8.10957 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 7.81535 6.51779 10.2402 7.75706 15.3128 8.12541 numMergedOcc 0
4 mol 42 unq 0 iso 0 dist 9.52043 8.53522 5.21506 4.8523 8.84148 5.52834 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.81722 8.65565 16.3901 9.33353 14.837 4.34694 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.27446 8.70465 4.63063 6.15303 10.0291 7.45777 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.76332 8.70465 4.68175 6.15303 9.27331 7.45777 numMergedOcc 0
8 mol 124 unq 0 iso 0 dist 8.25764 6.31955 5.26643 4.04981 10.619 7.18976 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.34402 8.58727 10.5962 8.50536 10.0093 8.8353 numMergedOcc 0
10 mol 136 unq 0 iso 0 dist 7.43436 9.87892 7.92003 9.61557 13.3304 8.41727 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 8.78461 7.66236 11.5932 9.42217 17.8399 9.94845 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.76509 7.74764 6.12748 6.46011 7.02662 6.72718 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 4.99993 7.76744 3.96154 5.38715 4.58291 8.51153 numMergedOcc 0
14 mol 229 unq 0 iso 0 dist 8.55126 7.06416 6.18209 8.28178 12.2056 7.39596 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 8.55696 9.17075 15.3115 13.8167 17.6089 9.0836 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 7.45814 9.17075 7.82572 13.8167 15.8656 9.0836 numMergedOcc 0
17 mol 266 unq 2 iso 0 dist 5.59326 7.68224 6.59851 10.5649 13.8187 9.0836 numMergedOcc 0
18 mol 266 unq 3 iso 0 dist 5.59326 9.8751 9.68718 10.5649 13.8187 9.62494 numMergedOcc 0
19 mol 266 unq 4 iso 0 dist 9.66652 7.68224 9.87926 10.5649 17.1671 9.0836 numMergedOcc 0
20 mol 266 unq 5 iso 0 dist 9.66652 9.8751 9.78063 10.5649 17.1671 9.62494 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 7.64708 8.90911 12.2251 8.3109 14.8085 6.66936 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 7.64708 8.90911 12.2251 16.7779 20.1164 8.15119 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 5.73065 8.90911 5.95045 8.3109 6.23539 6.66936 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 5.73065 8.90911 5.95045 16.7779 12.4458 8.15119 numMergedOcc 0
25 mol 281 unq 0 iso 0 dist 7.9542 5.84757 4.37855 4.93146 6.7897 6.58925 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 9.91042 9.00901 7.87494 11.231 9.47998 6.37998 numMergedOcc 0
27 mol 294 unq 1 iso 0 dist 9.91042 9.00901 7.87494 14.1974 5.76337 9.77023 numMergedOcc 0
