0 mol 7 unq 0 iso 0 dist 5.77374 8.57437 5.63739 4.01354 5.27578 8.94586 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 5.77374 5.63739 4.01354 8.94586 5.27578 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 7.28917 7.02173 4.18809 10.4547 9.32664 10.0536 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 5.68726 9.78545 6.18163 4.79924 9.71873 11.5958 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 7.46882 9.97998 6.18163 9.80492 9.71873 11.5958 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 8.52125 6.97361 10.2399 12.9454 9.95103 12.0785 numMergedOcc 0
6 mol 108 unq 0 iso 0 dist 9.82453 8.79452 9.29398 13.9156 8.06774 16.799 numMergedOcc 0
7 mol 108 unq 1 iso 0 dist 5.52402 7.57593 6.45014 5.97199 6.80069 12.2332 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 6.00651 8.52428 9.36152 7.38323 5.08863 13.8667 numMergedOcc 0
9 mol 147 unq 1 iso 0 dist 8.52428 6.00651 9.36152 6.78733 9.21191 10.8915 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 5.55129 6.60739 6.00563 5.03347 7.32163 10.5563 numMergedOcc 0
11 mol 148 unq 1 iso 0 dist 5.55129 9.22427 12.4819 5.03347 7.32163 13.1367 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 5.53778 6.71763 5.93818 4.80033 7.42372 10.5647 numMergedOcc 0
13 mol 150 unq 1 iso 0 dist 5.53778 9.32504 12.4343 4.80033 7.42372 13.062 numMergedOcc 0
14 mol 183 unq 0 iso 0 dist 9.92635 5.83335 14.4206 8.96895 5.5781 14.274 numMergedOcc 0
15 mol 183 unq 1 iso 0 dist 7.85507 9.86506 15.9375 6.57004 5.5781 15.3583 numMergedOcc 0
16 mol 183 unq 2 iso 0 dist 7.85507 7.86724 14.4206 6.57004 5.5781 14.274 numMergedOcc 0
17 mol 219 unq 0 iso 0 dist 9.52151 8.62654 16.4807 12.6614 9.30312 16.7933 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 8.14634 8.26851 5.09461 5.15747 9.02661 9.67276 numMergedOcc 0
