0 mol 26 unq 0 iso 0 dist 6.84751 5.43726 8.96682 8.01238 5.39199 6.7142 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 8.59794 6.56408 8.23784 5.22453 5.67846 5.22979 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 9.03928 5.38977 8.23784 7.27643 5.67846 5.22979 numMergedOcc 0
3 mol 30 unq 2 iso 0 dist 8.93805 4.87092 7.27243 7.90081 4.02746 5.22979 numMergedOcc 0
4 mol 30 unq 3 iso 0 dist 9.83449 5.85756 7.27243 9.8581 4.02746 5.22979 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 7.93454 12.5404 7.01952 14.1478 7.68459 6.88052 numMergedOcc 0
6 mol 34 unq 1 iso 0 dist 9.06898 12.5404 4.58552 14.1478 5.70782 6.88052 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.18572 5.4968 9.59729 11.2779 10.1364 7.46095 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 8.52697 3.89377 8.64934 6.9297 3.99035 7.43127 numMergedOcc 0
9 mol 107 unq 0 iso 0 dist 8.50257 10.6714 6.11492 10.0459 3.79393 5.33764 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 5.80831 4.03471 6.96745 9.67842 10.3457 8.06134 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 5.80831 4.03471 6.96745 5.93497 3.99855 5.36587 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 9.8564 16.6683 8.62504 11.4228 6.93712 9.0176 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 4.54218 6.90735 7.92216 10.9074 10.0208 6.65731 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 8.36316 13.0345 7.92216 16.0491 10.0208 6.65731 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.22792 5.44287 5.67168 9.49913 3.87169 6.56416 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 7.85696 5.44287 7.74579 9.49913 5.97542 6.56416 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 5.00402 5.44287 5.86483 9.49913 5.65634 6.56416 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 9.7713 5.22561 9.09594 10.2609 5.70985 8.24419 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 6.15704 9.92254 6.03081 14.0786 10.6687 8.97952 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 9.65996 6.49965 6.22943 11.2841 3.92782 8.6233 numMergedOcc 0
21 mol 292 unq 1 iso 0 dist 9.13412 6.49965 9.23612 11.2841 5.93687 8.6233 numMergedOcc 0
