0 mol 17 unq 0 iso 0 dist 5.41678 8.44037 5.22923 4.67446 7.30541 8.55161 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 7.77822 8.00338 6.65851 4.80937 10.2907 6.80828 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 6.34231 9.02073 3.30756 12.6645 9.12873 7.93498 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 6.24764 7.61514 3.81285 5.55433 6.27877 7.51319 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 6.24764 7.61514 3.81285 15.3673 10.5834 9.43839 numMergedOcc 0
5 mol 85 unq 2 iso 0 dist 6.24764 8.21116 6.17121 15.6112 14.5265 8.66427 numMergedOcc 0
6 mol 85 unq 3 iso 0 dist 6.24764 8.21116 6.17121 5.55433 6.27877 8.49887 numMergedOcc 0
7 mol 120 unq 0 iso 0 dist 8.99783 6.84006 5.90666 4.30031 10.1077 7.06763 numMergedOcc 0
8 mol 120 unq 1 iso 0 dist 7.30776 9.08322 5.90666 9.03773 10.1077 7.06763 numMergedOcc 0
9 mol 120 unq 2 iso 0 dist 8.82602 8.02114 5.90666 8.74749 10.1077 7.06763 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.44435 9.3776 5.0146 6.27142 11.606 9.07315 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 4.60553 5.23992 3.71345 7.86601 9.24242 8.79752 numMergedOcc 0
12 mol 176 unq 1 iso 0 dist 4.60553 9.1617 7.10617 7.86601 9.24242 7.58281 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 9.21721 6.15671 6.46348 5.61312 13.2337 7.78392 numMergedOcc 0
14 mol 249 unq 0 iso 0 dist 5.98732 5.3865 3.89698 5.7486 9.19506 6.62413 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 8.18538 8.34984 9.06758 6.3252 12.1961 6.3093 numMergedOcc 0
