0 mol 11 unq 0 iso 0 dist 7.93279 8.36387 11.9446 9.93748 8.23283 12.5016 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 7.93279 9.99647 7.51068 9.93748 8.23283 6.37748 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.31914 6.42242 9.51443 6.68961 6.64869 3.90503 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 8.83047 8.5021 9.61785 9.73556 11.4508 12.1729 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 6.0478 9.42982 5.89161 6.44825 9.4319 8.81493 numMergedOcc 0
5 mol 67 unq 1 iso 0 dist 6.0478 8.17929 12.4415 6.44825 9.4319 8.39222 numMergedOcc 0
6 mol 67 unq 2 iso 0 dist 6.0478 5.63802 10.8112 6.44825 9.4319 5.26394 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 7.50206 6.51968 8.06011 5.23695 11.1981 5.53655 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 7.50206 7.61237 5.19611 5.23695 11.1981 12.1608 numMergedOcc 0
9 mol 128 unq 2 iso 0 dist 6.4028 6.51968 6.42135 5.23695 9.21247 5.53655 numMergedOcc 0
10 mol 128 unq 3 iso 0 dist 6.4028 7.61237 4.68499 5.23695 9.21247 12.1608 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 6.81707 6.4751 9.18337 9.67711 6.1593 11.4851 numMergedOcc 0
12 mol 171 unq 1 iso 0 dist 6.81707 5.75085 8.83874 9.67711 6.1593 12.9811 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 4.0037 9.31172 11.4153 6.95244 10.7636 11.3761 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 4.0037 9.31172 11.4153 6.11224 9.14584 4.60149 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 9.42862 9.23676 7.34336 5.81438 11.0735 6.65648 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 9.98606 9.54381 8.62248 8.62843 10.4051 14.1115 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.84798 5.94449 5.89415 5.61134 8.8725 3.70525 numMergedOcc 0
18 mol 279 unq 1 iso 0 dist 8.84798 8.61452 14.0491 5.61134 8.8725 5.61412 numMergedOcc 0
19 mol 279 unq 2 iso 0 dist 8.84798 7.66302 15.1378 5.61134 8.8725 11.7578 numMergedOcc 0
