0 mol 48 unq 0 iso 0 dist 9.05165 7.4343 4.91237 8.68072 13.1965 8.52681 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 9.05165 7.4343 4.91237 6.69623 13.6682 9.98769 numMergedOcc 0
2 mol 81 unq 0 iso 0 dist 9.1024 8.61295 8.00722 3.71214 9.53663 8.57764 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 9.56049 7.6104 13.8571 11.4698 16.3792 5.13041 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 6.16537 7.95587 4.50663 5.99213 5.53454 9.0807 numMergedOcc 0
5 mol 103 unq 1 iso 0 dist 9.77978 7.95587 9.10567 5.99213 13.6891 9.0807 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.75007 6.29879 5.9683 9.60776 14.0737 8.98028 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 8.01303 8.68179 13.1232 6.25024 12.921 9.98672 numMergedOcc 0
8 mol 167 unq 1 iso 0 dist 8.01303 5.32056 9.13316 6.25024 12.921 7.84707 numMergedOcc 0
9 mol 188 unq 0 iso 0 dist 9.99509 7.82113 9.77899 5.20357 13.3673 7.50005 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 8.8495 8.96503 11.1756 8.98996 14.3507 4.93303 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 8.8495 8.96503 11.1756 8.73701 8.25174 9.95859 numMergedOcc 0
12 mol 205 unq 2 iso 0 dist 8.00688 8.96503 6.67537 8.98996 10.0133 4.93303 numMergedOcc 0
13 mol 205 unq 3 iso 0 dist 8.00688 8.96503 6.67537 8.73701 9.16671 9.95859 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 9.90909 8.64213 4.31175 3.83464 7.91213 5.86945 numMergedOcc 0
15 mol 237 unq 0 iso 0 dist 9.66939 9.43875 16.3432 7.05389 15.2818 8.75713 numMergedOcc 0
