0 mol 1 unq 0 iso 0 dist 8.27735 8.7275 4.50502 9.11012 9.72202 10.8122 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 6.41856 8.35401 3.96312 8.02898 9.55948 13.1035 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.13365 6.77987 10.2876 8.35576 8.0319 10.8893 numMergedOcc 0
3 mol 38 unq 0 iso 0 dist 9.70612 6.12374 10.622 13.6797 9.30722 15.6463 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.47617 7.86479 8.6477 11.3388 8.03754 6.57633 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 5.73331 7.86479 6.33831 4.09692 9.47348 11.5155 numMergedOcc 0
6 mol 55 unq 0 iso 0 dist 7.74108 9.873 6.06485 8.01383 6.7877 12.5951 numMergedOcc 0
7 mol 55 unq 1 iso 0 dist 7.74108 9.873 6.06485 4.42326 8.02261 12.0896 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.51543 8.18572 5.31985 5.51994 7.46657 6.55112 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 8.00525 6.64714 12.6799 13.1199 7.03536 16.456 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.11612 6.17349 4.48636 5.73904 7.9258 7.84768 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 5.11612 9.21978 6.63111 5.73904 7.9258 12.5457 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 7.00798 8.62413 12.1739 6.59051 9.1987 14.8046 numMergedOcc 0
13 mol 129 unq 1 iso 0 dist 7.00798 6.93102 5.63254 6.59051 9.1987 11.9391 numMergedOcc 0
14 mol 129 unq 2 iso 0 dist 7.00798 8.4375 8.26896 6.59051 9.1987 14.4301 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.94909 7.33743 15.0115 6.14253 9.47554 10.3522 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 7.14849 5.4647 6.42973 12.4035 9.63185 14.7977 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 6.15754 6.39499 5.53885 9.92466 5.46736 10.8796 numMergedOcc 0
