0 mol 1 unq 0 iso 0 dist 6.36522 6.35771 10.0096 7.55819 11.9886 5.65716 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 6.09309 6.69917 6.02451 13.6284 14.452 9.00593 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.06419 8.64844 14.262 13.6749 19.6422 7.27883 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 9.25043 5.96747 5.65236 5.84086 14.3717 9.77392 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 9.12845 8.2444 10.3047 7.08048 6.14602 7.03812 numMergedOcc 0
5 mol 71 unq 0 iso 0 dist 8.25891 8.87417 9.04607 13.2306 17.1882 8.67545 numMergedOcc 0
6 mol 86 unq 0 iso 0 dist 9.68632 8.18563 7.91946 3.71103 12.3098 8.71941 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 8.37011 5.82495 9.2948 6.50047 10.4713 7.98999 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 6.18528 9.14135 12.127 5.92269 11.122 5.06687 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 6.13554 9.12067 12.1375 5.95123 11.1553 5.09809 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 9.34814 7.55147 5.5911 5.42433 4.93595 5.36078 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.49656 9.87623 14.4919 13.1389 18.5334 9.47421 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 6.60512 9.95628 15.4691 12.1 17.5606 8.91912 numMergedOcc 0
13 mol 213 unq 1 iso 0 dist 6.99636 9.95628 8.10535 12.1 14.4816 8.91912 numMergedOcc 0
