0 mol 18 unq 0 iso 0 dist 9.4649 8.95573 10.3579 6.91413 15.2258 11.2059 8.1133 12.14 13.1509 7.59247 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 9.4649 8.95573 10.3579 6.91413 15.2258 11.2059 8.44727 12.9864 5.69024 6.92705 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 6.45965 8.95573 5.867 6.91413 5.9929 11.2059 8.1133 10.8265 13.1509 7.59247 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 6.45965 8.95573 5.867 6.91413 5.9929 11.2059 8.44727 3.91445 5.69024 6.92705 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 8.8717 14.7325 8.15141 5.39587 13.3334 8.82586 12.3532 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 9.12062 5.73257 10.7494 8.8717 14.7325 8.15141 6.47252 8.73415 5.65179 6.34254 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 6.35249 6.21143 5.27577 6.22124 9.90457 5.99852 6.94712 6.10822 6.06742 10.0644 numMergedOcc 0
7 mol 70 unq 0 iso 0 dist 9.2794 8.06918 11.9871 4.67358 10.1805 11.6542 8.63204 11.0976 15.7824 9.34622 numMergedOcc 0
8 mol 70 unq 1 iso 0 dist 9.2794 8.06918 11.9871 4.67358 10.1805 11.6542 5.4014 6.92915 12.3616 5.89735 numMergedOcc 0
9 mol 70 unq 2 iso 0 dist 9.2794 7.52623 9.5704 4.67358 10.1805 11.7156 8.63204 11.0976 13.3187 9.34622 numMergedOcc 0
10 mol 70 unq 3 iso 0 dist 9.2794 7.52623 9.5704 4.67358 10.1805 11.7156 5.4014 6.92915 10.3115 5.89735 numMergedOcc 0
11 mol 70 unq 4 iso 0 dist 9.2794 5.62294 10.9277 4.67358 10.1805 4.95817 8.63204 11.0976 4.77578 9.34622 numMergedOcc 0
12 mol 70 unq 5 iso 0 dist 9.2794 5.62294 10.9277 4.67358 10.1805 4.95817 5.4014 6.92915 4.14483 5.89735 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 5.8367 4.02705 8.05714 7.96353 11.0328 13.6552 11.1905 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 8.49649 8.80672 14.5276 5.8367 4.02705 13.6926 7.96353 11.0328 4.44936 11.1905 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 9.71025 5.81632 6.28784 6.03116 11.9291 8.33921 8.59532 7.4198 9.6584 9.30554 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 8.22643 6.90444 5.15519 8.08491 3.58901 8.82601 9.48862 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 4.91191 7.99897 5.3674 7.07507 5.72267 11.0789 7.69531 3.66075 6.206 6.89726 numMergedOcc 0
18 mol 247 unq 0 iso 0 dist 6.35578 6.34304 4.32191 9.27226 7.868 6.46689 8.85175 7.1875 8.72814 5.45083 numMergedOcc 0
19 mol 248 unq 0 iso 0 dist 8.4908 7.96942 8.23532 9.08064 11.3225 6.53154 5.65458 3.67057 6.71098 8.29191 numMergedOcc 0
