0 mol 16 unq 0 iso 0 dist 9.76968 5.98953 5.84479 13.862 5.32694 8.67719 12.1754 7.63133 6.53177 5.46498 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 6.36193 7.63046 7.84983 4.88613 4.81926 9.56737 5.40367 6.62496 11.5882 6.35756 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 4.88613 7.63046 9.56737 6.36193 4.81926 7.84983 5.40367 6.35756 11.5882 6.62496 numMergedOcc 0
3 mol 175 unq 0 iso 0 dist 8.58906 7.44933 9.57611 11.3098 9.24932 5.08206 18.4098 17.0633 12.1783 9.0018 numMergedOcc 0
4 mol 175 unq 1 iso 0 dist 8.58906 7.44933 9.57611 11.3098 9.24932 5.08206 12.3666 12.0591 7.28617 5.6234 numMergedOcc 0
5 mol 175 unq 2 iso 0 dist 8.58906 7.44933 9.57611 11.3098 9.24932 5.08206 12.3067 14.3157 5.77256 6.57069 numMergedOcc 0
6 mol 224 unq 0 iso 0 dist 8.39002 9.97999 9.33771 8.46129 5.0744 7.39839 6.31508 10.103 7.65225 6.65832 numMergedOcc 0
7 mol 224 unq 1 iso 0 dist 8.39002 9.97999 9.33771 8.46129 5.0744 7.39839 5.72088 6.57273 4.91322 6.60589 numMergedOcc 0
8 mol 224 unq 2 iso 0 dist 8.39002 9.97999 9.33771 8.46129 5.0744 7.39839 6.51315 5.78342 12.979 9.16166 numMergedOcc 0
9 mol 224 unq 3 iso 0 dist 8.46129 9.97999 7.39839 8.39002 5.0744 9.33771 9.98893 9.99123 5.41021 8.95269 numMergedOcc 0
10 mol 224 unq 4 iso 0 dist 8.46129 9.97999 7.39839 8.39002 5.0744 9.33771 5.72088 6.60589 4.91322 6.57273 numMergedOcc 0
11 mol 224 unq 5 iso 0 dist 8.46129 9.97999 7.39839 8.39002 5.0744 9.33771 6.51315 9.16166 12.979 5.78342 numMergedOcc 0
12 mol 231 unq 0 iso 0 dist 8.01942 7.25343 6.14348 9.97221 4.06055 7.79865 8.55683 8.40182 5.3251 7.37839 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.13537 4.34203 6.83152 9.01016 5.42006 5.24313 15.0245 10.0756 12.1448 7.31233 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 9.59174 5.24482 6.09782 10.3054 4.26007 5.81927 14.0839 10.9661 9.49027 6.97229 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 5.90645 6.13878 6.77279 9.73107 4.69778 9.58006 10.4985 8.13497 5.71237 7.88519 numMergedOcc 0
16 mol 259 unq 1 iso 0 dist 5.90645 6.13878 6.77279 9.73107 4.69778 9.58006 12.0753 9.95973 9.10984 7.84554 numMergedOcc 0
17 mol 259 unq 2 iso 0 dist 5.90645 6.13878 6.77279 9.73107 4.69778 9.58006 15.2324 10.3935 11.8501 7.46176 numMergedOcc 0
18 mol 259 unq 3 iso 0 dist 5.90645 6.13878 6.77279 9.73107 4.69778 9.58006 14.9117 12.6839 13.9868 9.18903 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 9.09967 10.88 9.86142 12.0329 5.34251 7.80446 17.0737 13.0736 6.57235 9.10818 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.96343 13.4151 9.02914 9.71491 7.08227 6.90434 18.2164 16.3537 13.2927 9.7748 numMergedOcc 0
