0 mol 7 unq 0 iso 0 dist 8.8255 6.24628 13.1656 8.48743 10.0453 8.63198 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 8.87499 5.9581 11.1809 7.15015 6.58841 5.81806 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 8.87499 5.9581 11.1809 3.68549 7.19972 5.39896 numMergedOcc 0
3 mol 30 unq 2 iso 0 dist 8.2359 5.9581 11.2046 7.15015 11.9061 5.81806 numMergedOcc 0
4 mol 30 unq 3 iso 0 dist 8.2359 5.9581 11.2046 3.68549 6.67111 5.39896 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 5.89962 8.86576 12.9089 9.25901 10.5837 7.74462 numMergedOcc 0
6 mol 90 unq 1 iso 0 dist 5.89962 8.86576 12.9089 7.96299 4.53359 11.6072 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.98255 8.07957 6.48973 8.95433 10.3096 6.80292 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 7.59599 7.21359 4.18399 6.0639 9.21913 5.85613 numMergedOcc 0
9 mol 186 unq 1 iso 0 dist 7.59599 7.21359 4.18399 6.91355 11.6591 10.0304 numMergedOcc 0
10 mol 186 unq 2 iso 0 dist 7.76429 7.21359 13.9887 6.0639 11.1768 5.85613 numMergedOcc 0
11 mol 186 unq 3 iso 0 dist 7.76429 7.21359 13.9887 6.91355 6.22624 10.0304 numMergedOcc 0
12 mol 186 unq 4 iso 0 dist 7.73733 7.21359 12.1847 6.0639 7.03438 5.85613 numMergedOcc 0
13 mol 186 unq 5 iso 0 dist 7.73733 7.21359 12.1847 6.91355 5.22317 10.0304 numMergedOcc 0
14 mol 229 unq 0 iso 0 dist 6.75338 8.55126 5.0114 8.53615 4.98446 9.75601 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 8.27047 8.2419 6.19365 6.03738 9.39461 5.45786 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 6.73161 7.62438 3.90122 8.00095 4.43593 4.67725 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 5.87353 7.97228 5.29874 9.07206 7.58851 8.32714 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 7.87214 7.97228 8.71052 9.07206 13.6874 8.32714 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 5.67503 9.04513 8.55227 8.49415 4.75685 13.1882 numMergedOcc 0
20 mol 265 unq 1 iso 0 dist 8.35562 9.04513 6.61067 8.49415 11.5105 13.1882 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 9.00434 8.55696 14.5738 6.95233 9.65978 5.928 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 9.00434 8.55696 14.5738 9.61741 18.4434 9.08196 numMergedOcc 0
23 mol 266 unq 2 iso 0 dist 9.00434 8.55696 14.5738 5.61056 13.7874 6.4179 numMergedOcc 0
24 mol 266 unq 3 iso 0 dist 9.00434 7.45814 6.10072 6.95233 9.65978 11.1633 numMergedOcc 0
25 mol 266 unq 4 iso 0 dist 9.00434 7.45814 6.10072 9.61741 18.4434 16.5582 numMergedOcc 0
26 mol 266 unq 5 iso 0 dist 9.00434 7.45814 6.10072 5.61056 13.7874 11.8299 numMergedOcc 0
