0 mol 5 unq 0 iso 0 dist 5.04052 5.80953 9.13355 6.40459 4.59167 6.99733 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.87863 7.18062 9.13355 8.58084 4.59167 6.99733 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 7.826 11.1303 8.95648 12.2105 6.46361 6.91876 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 6.86391 4.77947 5.87258 10.2423 4.6365 8.47518 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 4.61355 8.39995 6.03151 10.2991 6.28248 8.32948 numMergedOcc 0
5 mol 46 unq 1 iso 0 dist 4.61355 8.39995 6.03151 7.998 3.66253 7.43338 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 7.12529 9.42688 7.89184 8.34435 3.54989 4.80247 numMergedOcc 0
7 mol 56 unq 1 iso 0 dist 8.4185 9.42688 5.91948 8.34435 4.67834 4.80247 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 9.29532 8.84391 4.79891 11.0678 6.40382 5.26536 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.61511 3.94348 6.41759 9.67331 7.45747 6.00896 numMergedOcc 0
10 mol 162 unq 0 iso 0 dist 8.64101 15.345 8.0852 13.3049 8.69327 7.08934 numMergedOcc 0
11 mol 162 unq 1 iso 0 dist 8.64101 15.345 8.0852 13.1337 7.61345 8.87346 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 8.83844 9.37758 8.09699 10.5952 5.35456 4.59484 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 9.42723 17.0414 9.85404 13.7078 5.14649 7.62505 numMergedOcc 0
14 mol 198 unq 1 iso 0 dist 7.70823 8.29544 9.85404 10.2856 5.14649 7.62505 numMergedOcc 0
15 mol 198 unq 2 iso 0 dist 8.16611 12.7138 9.85404 11.5787 5.14649 7.62505 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 7.63908 7.51653 7.18098 8.96503 3.73699 6.02053 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.97859 10.2699 5.41453 8.66923 4.70535 7.75366 numMergedOcc 0
18 mol 247 unq 0 iso 0 dist 5.97717 9.2034 5.52484 6.63325 3.42642 8.64941 numMergedOcc 0
