0 mol 15 unq 0 iso 0 dist 6.16274 5.46344 8.85174 13.1646 11.4242 9.60736 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.88829 4.35522 7.26268 7.41509 5.27705 8.33273 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 6.47132 6.13703 6.56212 6.61052 5.44752 5.82829 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 9.74289 5.37144 7.39665 12.626 5.4779 8.76815 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.28058 15.8189 8.72682 17.3485 11.4473 8.85892 numMergedOcc 0
5 mol 144 unq 0 iso 0 dist 9.73668 8.35821 7.64028 13.9675 7.12825 8.85737 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 5.47189 6.7954 6.61112 9.67878 6.15341 5.09756 numMergedOcc 0
7 mol 211 unq 0 iso 0 dist 7.66285 4.80633 6.28595 9.05403 4.08758 5.75044 numMergedOcc 0
8 mol 225 unq 0 iso 0 dist 9.30186 6.38826 8.1945 10.5126 4.72643 6.20862 numMergedOcc 0
9 mol 225 unq 1 iso 0 dist 9.30186 6.38826 8.1945 10.0725 15.1562 7.27888 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 9.68636 9.76444 7.27993 13.4696 12.61 9.69367 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 4.94074 7.83075 8.51625 12.5554 10.8561 7.86214 numMergedOcc 0
12 mol 233 unq 1 iso 0 dist 4.94074 7.83075 8.51625 7.72115 5.19558 5.29501 numMergedOcc 0
13 mol 233 unq 2 iso 0 dist 4.94074 7.83075 8.51625 6.43615 6.48373 8.81206 numMergedOcc 0
14 mol 257 unq 0 iso 0 dist 6.50405 9.94726 8.83833 12.1701 9.4018 8.76085 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 9.89728 13.7396 5.85442 13.3472 5.69584 9.93282 numMergedOcc 0
16 mol 259 unq 1 iso 0 dist 9.89728 15.7491 6.95511 13.3472 5.69584 8.90555 numMergedOcc 0
17 mol 292 unq 0 iso 0 dist 6.02089 6.03672 9.9886 11.211 9.92863 8.71745 numMergedOcc 0
