0 mol 15 unq 0 iso 0 dist 7.58833 6.04271 6.31608 11.4586 11.6414 6.03257 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 5.77506 10.4794 9.42876 10.7002 6.64571 8.0543 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.5109 11.3064 7.11491 17.9031 11.505 8.29857 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 7.71747 11.476 7.1829 18.0202 11.5388 8.19993 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.38104 6.60364 6.89071 9.81484 8.93569 6.77241 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 8.38104 6.60364 6.89071 5.77527 3.98877 5.50508 numMergedOcc 0
6 mol 237 unq 0 iso 0 dist 8.5384 10.9723 8.95332 8.20201 5.18809 8.10254 numMergedOcc 0
7 mol 244 unq 0 iso 0 dist 9.13546 5.01275 9.30179 11.2975 8.74744 7.95359 numMergedOcc 0
8 mol 244 unq 1 iso 0 dist 9.13546 5.01275 9.30179 6.61951 13.2473 6.22122 numMergedOcc 0
9 mol 244 unq 2 iso 0 dist 7.58413 5.01275 4.4204 11.2975 5.00596 7.95359 numMergedOcc 0
10 mol 244 unq 3 iso 0 dist 7.58413 5.01275 4.4204 6.61951 5.68434 6.22122 numMergedOcc 0
11 mol 280 unq 0 iso 0 dist 6.78773 6.50588 9.47429 10.7155 8.71368 6.73712 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 6.21193 4.84387 9.23152 5.38333 5.9468 6.95912 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 8.13592 13.4847 9.23152 11.0292 5.9468 6.95912 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 6.21193 4.84387 9.23152 5.38333 5.9468 6.95912 numMergedOcc 0
15 mol 288 unq 1 iso 0 dist 8.13592 13.4847 9.23152 11.0292 5.9468 6.95912 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 6.21193 4.84387 9.23152 5.38333 5.9468 6.95912 numMergedOcc 0
17 mol 289 unq 1 iso 0 dist 8.13592 13.4847 9.23152 11.0292 5.9468 6.95912 numMergedOcc 0
