0 mol 43 unq 0 iso 0 dist 8.07389 9.35453 10.9858 12.7776 9.97844 19.2213 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 7.94809 6.27321 13.6446 10.7844 9.23087 15.7667 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.41961 5.40928 5.69897 10.0817 7.49737 10.4009 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 9.29166 5.76805 5.69897 11.3714 7.49737 10.4009 numMergedOcc 0
4 mol 70 unq 2 iso 0 dist 9.54062 6.13606 11.4024 11.6402 7.49737 13.6226 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.35752 8.64736 3.69039 6.86446 6.00779 9.35174 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.88238 8.64736 15.0328 12.5791 5.52283 15.997 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 8.58689 5.20528 6.64001 6.14753 5.98626 5.79841 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 7.82214 5.20528 4.58085 6.14753 7.54915 5.79841 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.39787 8.51206 4.31811 10.5189 9.08102 9.10677 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 6.94623 6.08299 5.51309 8.7669 7.59996 9.46933 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 5.7306 8.85675 11.9741 13.588 9.58365 18.5193 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 5.38508 9.45718 6.84735 5.19282 6.04056 10.9524 numMergedOcc 0
13 mol 197 unq 1 iso 0 dist 5.38508 8.56826 7.92095 5.19282 6.04056 12.2342 numMergedOcc 0
14 mol 197 unq 2 iso 0 dist 6.51529 9.45718 10.9225 5.19282 5.5343 10.9524 numMergedOcc 0
15 mol 197 unq 3 iso 0 dist 6.51529 8.56826 11.6499 5.19282 5.5343 12.2342 numMergedOcc 0
16 mol 197 unq 4 iso 0 dist 6.18166 9.3055 5.47413 13.2776 8.8252 13.0266 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 8.57319 5.88992 9.12199 6.7582 7.01604 6.14304 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 6.0626 7.32216 4.09076 5.42692 9.16869 7.64854 numMergedOcc 0
19 mol 224 unq 1 iso 0 dist 6.0626 9.92206 6.69164 5.42692 9.16869 12.3472 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 8.89904 9.35785 4.71431 10.5502 8.24853 11.0977 numMergedOcc 0
