0 mol 1 unq 0 iso 0 dist 5.87976 8.83387 4.93091 4.49401 7.21349 8.15672 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.71167 9.85305 4.93091 5.72763 7.21349 8.15672 numMergedOcc 0
2 mol 2 unq 0 iso 0 dist 5.69072 7.60935 6.93149 6.99962 5.42021 9.78005 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.99618 6.45955 9.93156 4.76152 12.5999 7.94132 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 6.03428 7.94697 7.93947 11.2863 13.9142 9.53663 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 8.8763 7.91691 13.4361 3.97596 12.4937 8.60172 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.04398 6.38269 8.81921 12.0115 16.3086 7.96893 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.08733 6.66313 3.80816 7.36057 11.3476 8.42225 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 4.90449 6.3646 3.80816 11.1403 11.3476 8.42225 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 9.35529 7.64841 3.71884 9.0362 8.43293 8.03124 numMergedOcc 0
10 mol 169 unq 0 iso 0 dist 6.57161 9.3206 7.16323 13.9828 14.1142 7.50458 numMergedOcc 0
11 mol 185 unq 0 iso 0 dist 8.86187 9.62449 3.15736 12.1385 10.933 8.07469 numMergedOcc 0
12 mol 185 unq 1 iso 0 dist 9.27825 9.62449 5.80135 12.1385 9.56016 8.07469 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.75853 8.19926 8.26669 11.641 16.9425 9.14525 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 9.22999 8.73456 5.73222 6.85536 11.3595 8.60252 numMergedOcc 0
15 mol 272 unq 0 iso 0 dist 6.20857 7.08918 8.90381 7.83331 10.1234 9.99134 numMergedOcc 0
16 mol 292 unq 0 iso 0 dist 6.38051 4.97488 5.55248 10.841 14.109 8.85506 numMergedOcc 0
