0 mol 90 unq 0 iso 0 dist 5.42653 10.7366 7.54496 9.48551 9.56752 6.44963 numMergedOcc 0
1 mol 90 unq 1 iso 0 dist 8.71991 7.4595 7.54496 7.0274 9.56752 6.44963 numMergedOcc 0
2 mol 119 unq 0 iso 0 dist 9.87854 7.79265 9.05798 8.10869 7.26955 7.34151 numMergedOcc 0
3 mol 119 unq 1 iso 0 dist 9.87854 11.822 5.85818 8.10869 7.26955 11.7884 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 4.86894 4.88215 6.40901 10.4027 9.30424 5.99865 numMergedOcc 0
5 mol 143 unq 1 iso 0 dist 4.86894 8.25783 9.40626 10.4027 9.30424 11.2236 numMergedOcc 0
6 mol 146 unq 0 iso 0 dist 8.48719 5.43323 8.68349 4.96984 6.50043 7.20408 numMergedOcc 0
7 mol 146 unq 1 iso 0 dist 8.48719 5.43323 8.68349 7.70916 9.44952 6.00811 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 4.7785 3.97123 8.12589 6.57631 8.73468 7.23332 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 4.7785 3.97123 8.12589 8.40891 9.73927 7.89336 numMergedOcc 0
10 mol 150 unq 0 iso 0 dist 4.79493 3.98367 8.11592 6.56068 8.73558 7.35366 numMergedOcc 0
11 mol 150 unq 1 iso 0 dist 4.79493 3.98367 8.11592 8.32178 9.66129 7.86976 numMergedOcc 0
12 mol 159 unq 0 iso 0 dist 9.41487 7.80555 7.13269 4.87811 5.9032 7.97232 numMergedOcc 0
13 mol 192 unq 0 iso 0 dist 8.15486 6.93447 8.53433 5.76622 7.33225 3.86183 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.03093 9.08442 8.8827 15.0148 7.02079 12.6361 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 9.03093 9.08442 8.8827 5.93253 5.88802 4.04521 numMergedOcc 0
16 mol 272 unq 0 iso 0 dist 5.84116 12.6613 6.98048 6.09891 9.24417 14.2062 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 7.05438 5.37654 9.80746 10.7441 7.48235 14.8957 numMergedOcc 0
18 mol 278 unq 1 iso 0 dist 7.08899 14.615 9.80746 3.5882 7.48235 14.8957 numMergedOcc 0
