0 mol 18 unq 0 iso 0 dist 7.66002 8.81762 6.6768 6.30855 8.71729 13.066 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 7.66002 5.32149 10.1168 6.30855 8.71729 11.4715 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 8.86576 9.25901 7.74462 11.6676 9.05357 16.0024 numMergedOcc 0
3 mol 90 unq 1 iso 0 dist 8.86576 7.96299 11.6072 11.6676 9.05357 17.2416 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 5.15752 8.84131 5.54551 6.87786 9.50209 9.94856 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 8.0631 6.37528 5.56084 4.55723 5.60716 6.87861 numMergedOcc 0
6 mol 115 unq 1 iso 0 dist 8.90273 6.37528 6.98664 4.55723 5.52706 6.87861 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 6.1299 7.73769 5.4432 5.57883 5.90772 9.60643 numMergedOcc 0
8 mol 195 unq 0 iso 0 dist 9.39921 4.78641 12.0021 7.08314 9.30817 9.36654 numMergedOcc 0
9 mol 222 unq 0 iso 0 dist 8.81385 7.88846 4.28891 5.66378 5.04916 7.18956 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 6.82475 9.03917 11.9319 4.25998 7.29546 10.4621 numMergedOcc 0
11 mol 235 unq 1 iso 0 dist 6.82475 6.56775 5.19684 4.25998 7.29546 5.65339 numMergedOcc 0
12 mol 235 unq 2 iso 0 dist 9.37896 7.8128 5.47633 7.62542 8.60471 9.58736 numMergedOcc 0
13 mol 273 unq 0 iso 0 dist 8.24507 9.79022 9.45651 9.70951 6.8391 15.6072 numMergedOcc 0
14 mol 273 unq 1 iso 0 dist 8.24507 9.79022 9.45651 5.35494 6.06557 10.3657 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 5.73065 9.38793 12.4605 6.75676 6.73204 14.4381 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 5.7099 9.91518 9.40662 7.70648 7.76881 6.35287 numMergedOcc 0
