0 mol 43 unq 0 iso 0 dist 9.36315 9.34433 9.87265 6.84521 14.141 12.3867 5.9674 9.64058 7.32913 12.0317 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.36315 9.34433 9.87265 8.90024 16.9053 12.0037 5.9674 9.64058 7.32913 12.0919 numMergedOcc 0
2 mol 43 unq 2 iso 0 dist 9.36315 9.34433 9.87265 6.78532 11.5022 6.9067 5.9674 9.64058 7.32913 9.47348 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 9.00943 6.09042 10.8346 8.27156 4.05764 10.894 11.2147 17.6992 9.11512 18.5792 numMergedOcc 0
4 mol 94 unq 0 iso 0 dist 6.33571 6.63924 4.84577 6.31237 9.24549 6.0901 4.48902 8.30781 9.25496 10.0945 numMergedOcc 0
5 mol 187 unq 0 iso 0 dist 9.469 9.55621 11.1486 9.38169 10.7804 4.98423 9.61673 15.1017 5.58167 6.82787 numMergedOcc 0
6 mol 187 unq 1 iso 0 dist 9.469 9.55621 11.1486 9.38169 10.7804 4.98423 12.9459 12.8865 8.0501 12.7503 numMergedOcc 0
7 mol 206 unq 0 iso 0 dist 6.38821 9.0815 11.5097 9.90891 13.8408 5.91558 7.03455 12.0228 6.52136 8.45825 numMergedOcc 0
8 mol 206 unq 1 iso 0 dist 5.98212 9.0815 7.44363 9.90891 11.5281 5.91558 7.03455 5.90912 6.52136 8.45825 numMergedOcc 0
9 mol 206 unq 2 iso 0 dist 7.16312 9.0815 11.8011 9.90891 15.4153 5.91558 7.03455 9.97579 6.52136 8.45825 numMergedOcc 0
10 mol 209 unq 0 iso 0 dist 9.53736 9.20752 5.14198 5.92907 7.92746 9.95971 9.95813 12.4646 9.07668 11.1427 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 6.21062 8.33143 12.3986 8.14464 4.77967 14.7684 8.88571 10.6656 7.65121 14.9243 numMergedOcc 0
12 mol 225 unq 1 iso 0 dist 6.21062 8.33143 12.3986 9.93754 15.6895 6.89798 8.88571 10.6656 7.65121 13.147 numMergedOcc 0
13 mol 225 unq 2 iso 0 dist 7.26267 8.33143 4.8373 8.14464 12.1867 14.7684 8.88571 11.1564 7.65121 14.9243 numMergedOcc 0
14 mol 225 unq 3 iso 0 dist 7.26267 8.33143 4.8373 9.93754 5.92569 6.89798 8.88571 11.1564 7.65121 13.147 numMergedOcc 0
15 mol 252 unq 0 iso 0 dist 8.19911 5.41885 10.2256 7.91348 7.00892 5.96471 6.93011 13.7174 8.19645 13.2165 numMergedOcc 0
16 mol 271 unq 0 iso 0 dist 6.67008 7.34621 8.83991 7.9494 5.46826 4.87282 7.6271 13.8649 9.00071 12.7676 numMergedOcc 0
17 mol 281 unq 0 iso 0 dist 9.60142 6.81536 13.2822 9.37845 10.7592 5.81338 9.38089 17.7 7.65321 12.2104 numMergedOcc 0
