0 mol 19 unq 0 iso 0 dist 5.9255 8.87604 3.86173 5.02625 7.14945 10.0338 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 5.9255 8.87604 3.86173 6.50749 6.50337 10.3056 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 8.6615 9.28637 3.61632 15.544 7.16149 7.51452 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 4.73829 7.88689 5.55523 4.73978 6.44791 11.5074 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 7.55255 9.9724 3.72006 9.93676 7.09757 7.26024 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 5.58724 8.59945 5.2359 8.48982 7.09757 6.36086 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 4.82824 6.16338 3.69039 8.21111 5.62694 8.75826 numMergedOcc 0
7 mol 107 unq 0 iso 0 dist 7.06322 8.92347 11.2991 9.85159 7.02709 16.009 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 5.6738 5.7085 8.69658 11.224 5.82487 14.1308 numMergedOcc 0
9 mol 192 unq 0 iso 0 dist 5.25555 5.64003 3.72014 4.98976 8.91445 10.4789 numMergedOcc 0
10 mol 196 unq 0 iso 0 dist 6.23804 4.83135 3.68546 9.99132 6.11835 6.86319 numMergedOcc 0
11 mol 196 unq 1 iso 0 dist 6.66019 4.83135 6.56216 9.99132 9.93668 6.86319 numMergedOcc 0
12 mol 251 unq 0 iso 0 dist 4.63025 7.52286 7.33882 5.60154 9.207 8.68707 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 6.26195 9.43704 5.58975 7.6323 7.98028 12.2124 numMergedOcc 0
14 mol 258 unq 1 iso 0 dist 6.26195 9.43704 5.58975 6.30874 5.8473 7.6595 numMergedOcc 0
15 mol 258 unq 2 iso 0 dist 6.26195 7.41653 11.0519 7.6323 7.98028 14.1388 numMergedOcc 0
16 mol 258 unq 3 iso 0 dist 6.26195 7.41653 11.0519 6.30874 5.8473 10.3917 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 6.52552 6.99454 10.3547 5.26386 8.2179 6.71375 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 7.06369 8.70172 9.87956 8.38263 8.89057 15.5147 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 7.06369 8.70172 9.87956 12.0507 7.97266 17.6996 numMergedOcc 0
