0 mol 10 unq 0 iso 0 dist 8.44864 8.55472 5.66059 9.36515 5.40169 6.178 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.17217 5.36736 9.7004 5.16784 6.74848 10.2996 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 9.45566 9.70501 5.81645 6.36853 7.03307 5.75226 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 7.07989 7.11791 8.67118 5.79348 8.91427 11.7387 numMergedOcc 0
4 mol 68 unq 1 iso 0 dist 9.77272 10.2318 8.67118 11.1344 8.91427 11.7387 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 7.75211 13.4991 9.61367 5.25697 6.66954 8.88275 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 7.7913 13.8441 6.48163 7.34488 9.05259 12.5077 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 5.94696 4.67787 8.48678 11.7159 8.43352 13.9427 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.16592 10.4955 6.36749 15.7109 9.5669 10.3606 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.4733 9.90172 8.05937 6.64646 9.9151 5.53632 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 7.81715 7.9441 8.68243 15.0568 9.79069 13.082 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.58256 9.4381 8.09667 5.47232 5.45675 5.37893 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 7.4513 11.1507 7.58118 5.37508 5.37796 6.71715 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 7.04477 12.8829 6.82883 7.77366 6.26945 7.21532 numMergedOcc 0
14 mol 226 unq 1 iso 0 dist 7.04477 14.6433 8.22518 7.77366 6.26945 12.0613 numMergedOcc 0
15 mol 226 unq 2 iso 0 dist 7.04477 7.06868 6.02803 7.77366 6.26945 10.6196 numMergedOcc 0
16 mol 257 unq 0 iso 0 dist 9.34004 4.3984 6.8256 5.21929 9.43042 8.24228 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 8.76332 15.3037 9.23037 3.60708 6.74142 11.8168 numMergedOcc 0
