0 mol 76 unq 0 iso 0 dist 8.84839 4.66377 5.50141 8.26803 9.6212 9.86664 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 6.00131 5.22996 4.36639 7.25403 10.5758 7.0561 numMergedOcc 0
2 mol 130 unq 0 iso 0 dist 8.67153 6.87562 10.6944 3.79867 11.8708 6.5739 numMergedOcc 0
3 mol 143 unq 0 iso 0 dist 8.22353 6.93136 7.12863 9.88555 12.1784 7.16698 numMergedOcc 0
4 mol 143 unq 1 iso 0 dist 8.22353 6.93136 7.12863 12.1494 7.46803 8.68663 numMergedOcc 0
5 mol 183 unq 0 iso 0 dist 8.57818 6.40448 5.45974 5.62792 10.9213 9.20493 numMergedOcc 0
6 mol 195 unq 0 iso 0 dist 9.71653 5.46768 5.15519 4.79025 11.2434 6.34234 numMergedOcc 0
7 mol 195 unq 1 iso 0 dist 9.71653 5.46768 5.15519 6.01032 9.74988 7.87972 numMergedOcc 0
8 mol 222 unq 0 iso 0 dist 7.46845 9.04499 11.8794 12.9462 14.2305 7.97027 numMergedOcc 0
9 mol 222 unq 1 iso 0 dist 7.46845 9.04499 11.8794 11.0561 16.8245 6.81955 numMergedOcc 0
10 mol 222 unq 2 iso 0 dist 7.46845 9.04499 11.8794 9.50604 14.562 4.9876 numMergedOcc 0
11 mol 227 unq 0 iso 0 dist 6.37369 9.33735 5.23507 13.5696 10.4959 5.28771 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 9.51945 8.83751 16.965 3.28983 12.7622 6.43209 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 9.51945 8.77688 14.1937 3.28983 12.7622 8.48769 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 7.58405 8.54084 4.48119 4.35925 8.5613 9.65775 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 7.58405 8.54084 4.48119 13.8859 11.4535 9.50634 numMergedOcc 0
16 mol 260 unq 2 iso 0 dist 7.26115 8.54084 5.32038 4.35925 5.7791 9.65775 numMergedOcc 0
17 mol 260 unq 3 iso 0 dist 7.26115 8.54084 5.32038 13.8859 14.574 9.50634 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 5.45375 9.98606 8.12927 9.91008 11.6498 8.20485 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 9.9145 9.98606 5.78726 9.91008 12.9928 8.20485 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 5.81721 7.88343 9.44756 9.35656 12.6997 5.81528 numMergedOcc 0
