0 mol 19 unq 0 iso 0 dist 8.40009 6.50749 8.78293 10.7834 6.2337 7.75618 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.97657 11.5539 8.23643 18.8837 14.4867 7.75618 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 5.46378 6.44262 7.685 13.1674 12.9735 8.6653 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 4.31912 10.2135 8.68559 7.98414 7.14527 7.99969 numMergedOcc 0
4 mol 52 unq 0 iso 0 dist 9.28632 6.01116 7.18176 8.72923 6.29814 6.31696 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.62501 5.83686 8.24062 8.55279 7.0313 6.73347 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 6.96357 7.23362 7.20326 13.2237 9.79891 7.70232 numMergedOcc 0
7 mol 117 unq 1 iso 0 dist 6.96357 7.23362 7.20326 13.9119 9.97229 7.4671 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 6.47176 7.68038 8.61331 13.7378 13.7844 7.33273 numMergedOcc 0
9 mol 176 unq 1 iso 0 dist 8.92131 4.68256 8.61331 10.3778 13.7844 7.33273 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 9.03971 13.7762 9.52936 14.6588 7.4793 6.42735 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 7.62634 5.69334 6.47873 7.27978 10.7231 8.65535 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 9.47487 17.6057 8.99696 16.6028 11.1666 7.50013 numMergedOcc 0
13 mol 197 unq 1 iso 0 dist 9.47487 17.6057 8.99696 20.7249 13.3562 5.81233 numMergedOcc 0
14 mol 197 unq 2 iso 0 dist 9.47487 17.6057 8.99696 11.3825 4.59269 6.92924 numMergedOcc 0
15 mol 197 unq 3 iso 0 dist 9.47487 17.6057 8.99696 19.7714 12.9766 7.14306 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 5.99388 5.19951 6.16063 8.88567 5.70413 6.30154 numMergedOcc 0
17 mol 234 unq 1 iso 0 dist 5.99388 5.19951 6.16063 9.45787 7.17691 7.32499 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 6.88731 6.94683 7.39747 8.05132 5.2908 9.01021 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 6.61098 15.2943 9.5784 19.7646 13.9064 7.16853 numMergedOcc 0
20 mol 264 unq 1 iso 0 dist 6.25794 12.3535 9.5784 18.3919 13.9064 7.16853 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 9.67306 5.20105 6.35287 12.3863 7.83538 8.00673 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 8.53405 6.2858 6.4778 12.4609 12.237 6.89451 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 8.53405 6.2858 6.4778 12.4609 12.237 6.89451 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 8.53405 6.2858 6.4778 12.4609 12.237 6.89451 numMergedOcc 0
