0 mol 0 unq 0 iso 0 dist 9.94618 6.94181 14.0556 5.76921 13.7495 9.07223 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.58865 7.32392 8.54694 7.20175 10.2812 7.5706 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 9.72314 9.28932 10.6695 8.50298 9.07692 5.61656 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 9.72314 9.28932 10.6695 12.5461 13.8493 7.22242 numMergedOcc 0
4 mol 30 unq 2 iso 0 dist 9.72314 6.83481 6.40527 8.50298 9.07692 6.95343 numMergedOcc 0
5 mol 30 unq 3 iso 0 dist 9.77521 7.47342 5.39896 6.94189 11.4581 7.27268 numMergedOcc 0
6 mol 52 unq 0 iso 0 dist 9.67023 5.26018 6.86126 9.9383 9.97559 5.75761 numMergedOcc 0
7 mol 52 unq 1 iso 0 dist 6.86785 7.1203 6.55558 5.29002 6.56768 5.75761 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 7.84699 8.124 5.2774 16.278 12.6162 9.79143 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 8.40844 8.124 5.44275 16.278 8.91833 9.79143 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 6.99156 8.124 8.0624 16.278 13.2626 9.79143 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 7.02351 8.16299 11.2674 5.9581 8.91833 6.43377 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 8.30003 7.0318 10.4589 9.50632 16.7861 8.2236 numMergedOcc 0
13 mol 219 unq 0 iso 0 dist 7.98941 6.8424 10.9246 10.7226 9.59958 8.69579 numMergedOcc 0
14 mol 230 unq 0 iso 0 dist 5.00735 5.62804 7.07028 6.73176 10.3976 5.31963 numMergedOcc 0
15 mol 230 unq 1 iso 0 dist 5.00735 9.3619 11.491 6.73176 10.3976 7.85632 numMergedOcc 0
16 mol 230 unq 2 iso 0 dist 6.73755 5.62804 5.26217 6.73176 10.2211 5.31963 numMergedOcc 0
17 mol 230 unq 3 iso 0 dist 6.73755 9.3619 7.46522 6.73176 10.2211 7.85632 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 4.21935 6.83046 5.29737 5.86234 7.84904 5.45139 numMergedOcc 0
19 mol 252 unq 0 iso 0 dist 7.74647 6.41821 4.98533 6.80158 9.53444 6.68262 numMergedOcc 0
20 mol 256 unq 0 iso 0 dist 8.11884 5.98967 9.07441 8.0817 6.5266 9.72168 numMergedOcc 0
