0 mol 10 unq 0 iso 0 dist 8.98746 8.65597 6.68744 11.1175 3.25792 9.75001 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.98746 8.65597 6.68744 6.47443 4.68389 9.06457 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.89914 5.90358 8.00784 12.7499 5.2495 9.21084 numMergedOcc 0
3 mol 45 unq 0 iso 0 dist 7.55443 4.80098 7.18002 11.2849 9.51166 8.81519 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 7.32699 14.0438 9.77004 12.3975 5.22869 8.94842 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 7.32699 14.0438 9.77004 11.5817 4.48872 9.9555 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 6.45933 10.6879 9.77004 11.0041 5.22869 8.94842 numMergedOcc 0
7 mol 48 unq 3 iso 0 dist 6.45933 10.6879 9.77004 9.35075 4.48872 9.9555 numMergedOcc 0
8 mol 48 unq 4 iso 0 dist 7.05964 6.21973 9.54119 7.39468 4.91531 9.07969 numMergedOcc 0
9 mol 48 unq 5 iso 0 dist 7.05964 6.21973 9.54119 5.55714 4.38297 9.61448 numMergedOcc 0
10 mol 48 unq 6 iso 0 dist 9.90758 17.4974 9.54119 13.7268 4.91531 9.07969 numMergedOcc 0
11 mol 48 unq 7 iso 0 dist 9.90758 17.4974 9.54119 13.9652 4.38297 9.61448 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 8.04794 5.44659 4.86696 13.1448 5.61023 8.44819 numMergedOcc 0
13 mol 116 unq 0 iso 0 dist 8.0237 6.70003 9.82654 10.8476 6.51576 9.63281 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 4.93944 13.1656 9.80185 15.4796 13.0092 4.33805 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 7.14918 8.65126 7.01673 8.03092 3.13463 8.9327 numMergedOcc 0
16 mol 276 unq 0 iso 0 dist 9.33041 7.93109 9.08396 8.51449 3.50268 7.11952 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 6.69403 4.49194 9.14721 5.63358 6.18318 4.86946 numMergedOcc 0
18 mol 283 unq 1 iso 0 dist 5.76694 4.49194 7.15322 5.63358 3.34167 4.86946 numMergedOcc 0
19 mol 283 unq 2 iso 0 dist 9.33601 5.2842 8.91437 8.39635 3.12129 9.60873 numMergedOcc 0
