0 mol 28 unq 0 iso 0 dist 9.32784 10.9344 5.75809 18.5465 11.6229 8.79638 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 9.32784 10.9344 5.75809 11.4931 8.39028 6.42785 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.10681 15.0854 7.07773 15.9124 7.67336 9.48195 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 7.47638 3.96491 8.5893 9.60381 15.861 8.22608 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 6.9327 9.16104 9.80946 10.5316 7.82906 5.89913 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 8.06519 3.42062 7.32699 7.54027 5.65467 6.45933 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 7.54027 3.42062 6.45933 8.06519 5.65467 7.32699 numMergedOcc 0
7 mol 48 unq 2 iso 0 dist 8.12546 3.47529 7.05964 10.1113 16.4417 9.90758 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.87984 9.40876 8.73798 9.0584 5.4823 5.24616 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 9.0584 9.40876 5.24616 8.87984 5.4823 8.73798 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 6.05736 9.87425 6.82267 12.364 8.32683 7.70636 numMergedOcc 0
11 mol 116 unq 1 iso 0 dist 8.34007 6.88393 6.82267 12.6494 8.32683 7.70636 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 7.71664 5.17954 9.04366 12.0385 13.7304 8.12319 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 7.10646 9.35225 5.04072 14.9786 8.85948 9.531 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 9.92578 3.53612 7.70811 13.272 10.176 9.98144 numMergedOcc 0
