0 mol 1 unq 0 iso 0 dist 6.41817 6.24156 3.81243 7.94217 6.26921 6.93809 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 6.75307 9.21811 10.8132 13.8759 17.4741 9.53382 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 7.24775 9.21811 13.4461 13.8759 14.2832 9.53382 numMergedOcc 0
3 mol 36 unq 0 iso 0 dist 7.11464 6.1084 8.96522 10.4952 16.525 9.55519 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 9.52676 6.86391 10.5941 4.77947 13.3441 5.87258 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 6.19084 4.61355 4.07933 8.39995 8.90992 6.03151 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 8.14607 4.88863 3.85627 6.56112 8.38855 7.41141 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 7.38868 8.2282 3.85627 6.29707 8.38855 7.41141 numMergedOcc 0
8 mol 68 unq 2 iso 0 dist 9.04129 8.2282 7.15683 6.29707 12.5354 7.41141 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 7.43804 7.6935 3.92737 10.991 8.48678 6.74197 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.45931 7.20083 11.0215 5.60415 12.3067 6.10658 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 6.35397 7.20083 10.7779 5.60415 11.5552 6.10658 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 9.90113 8.64101 9.03836 15.345 10.6706 8.0852 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.47112 7.63908 5.19196 7.51653 9.9964 7.18098 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 9.47112 7.63908 5.19196 10.7616 14.313 9.27084 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 8.03226 9.97859 13.8857 10.2699 13.6179 5.41453 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 9.36891 6.63442 9.93952 4.06836 12.1813 8.76604 numMergedOcc 0
17 mol 279 unq 1 iso 0 dist 7.37358 6.63442 4.05042 4.06836 10.4383 8.76604 numMergedOcc 0
