0 mol 21 unq 0 iso 0 dist 7.88429 6.29808 7.08873 10.7179 8.85347 7.30688 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 9.70612 6.12374 10.622 5.39032 11.7939 4.74069 numMergedOcc 0
2 mol 38 unq 1 iso 0 dist 6.46781 6.12374 6.10572 5.39032 8.86547 4.74069 numMergedOcc 0
3 mol 38 unq 2 iso 0 dist 8.19077 6.12374 4.40004 5.39032 8.80956 4.74069 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.99509 7.86479 11.2061 12.4205 15.7133 9.04117 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.99509 7.86479 11.2061 5.71606 12.9917 6.34215 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 8.47617 7.86479 8.6477 12.4205 10.9455 9.04117 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 8.47617 7.86479 8.6477 5.71606 10.2065 6.34215 numMergedOcc 0
8 mol 43 unq 4 iso 0 dist 5.73331 7.86479 6.33831 12.4205 13.4358 9.04117 numMergedOcc 0
9 mol 43 unq 5 iso 0 dist 5.73331 7.86479 6.33831 5.71606 9.08164 6.34215 numMergedOcc 0
10 mol 43 unq 6 iso 0 dist 8.48694 7.86479 4.46233 12.4205 13.4959 9.04117 numMergedOcc 0
11 mol 43 unq 7 iso 0 dist 8.48694 7.86479 4.46233 5.71606 9.21303 6.34215 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 8.51543 8.18572 5.31985 5.2446 11.272 8.12959 numMergedOcc 0
13 mol 76 unq 1 iso 0 dist 9.32453 8.25047 6.77898 7.13692 11.7544 6.14248 numMergedOcc 0
14 mol 76 unq 2 iso 0 dist 9.32453 8.25047 6.77898 8.29882 4.83274 6.97936 numMergedOcc 0
15 mol 76 unq 3 iso 0 dist 9.32453 8.25047 6.77898 9.77859 7.89214 5.00466 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 4.31067 7.63284 7.03983 9.79578 10.8197 6.84952 numMergedOcc 0
17 mol 129 unq 0 iso 0 dist 7.00798 8.62413 12.1739 9.72618 10.1938 8.85652 numMergedOcc 0
18 mol 129 unq 1 iso 0 dist 7.00798 8.4375 8.26896 9.72618 10.1938 9.31543 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 6.76166 9.13631 11.5407 8.85304 13.6135 5.20195 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 7.2977 9.13631 5.91192 8.85304 9.56984 5.20195 numMergedOcc 0
21 mol 173 unq 0 iso 0 dist 9.09857 5.82174 3.74688 5.45307 9.61566 6.11224 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 9.23844 8.15661 5.53809 5.0997 9.85857 6.16832 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 6.15754 6.39499 5.53885 7.32865 12.0854 8.68934 numMergedOcc 0
24 mol 234 unq 1 iso 0 dist 8.9413 6.39499 3.95629 7.32865 12.332 8.68934 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 8.44108 9.18386 7.09754 5.44638 10.2838 9.24101 numMergedOcc 0
