0 mol 0 unq 0 iso 0 dist 7.19397 6.8892 11.5675 7.1599 7.19621 11.788 12.3538 9.95 11.9892 9.6994 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.19397 6.8892 11.5675 7.1599 7.19621 11.788 5.55156 6.83587 5.85361 7.15528 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.27331 7.45777 4.68175 10.163 9.72442 11.7079 15.2052 11.7069 12.5789 9.38498 numMergedOcc 0
3 mol 129 unq 0 iso 0 dist 7.07421 7.6453 5.06265 4.80675 6.29026 8.00624 10.1938 11.5533 15.4586 8.54584 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 9.6582 9.23104 12.4825 16.3678 9.48243 19.3424 19.1009 11.6637 24.1043 9.91388 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 9.07294 5.79195 5.35551 13.1243 8.84018 9.64659 15.4604 8.00493 10.2681 6.5107 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 7.50126 9.2759 5.35551 15.9524 8.84018 9.64659 12.9713 8.00493 10.2681 6.5107 numMergedOcc 0
7 mol 210 unq 0 iso 0 dist 6.41444 8.05949 7.48216 13.3774 9.67457 15.5817 10.5902 5.82028 13.1832 6.18308 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 7.86207 9.89039 9.09963 10.6943 9.8711 15.6403 8.9077 4.90657 13.6952 9.23153 numMergedOcc 0
9 mol 220 unq 1 iso 0 dist 7.86207 8.57174 14.3078 10.6943 9.8711 18.2814 8.9077 4.90657 13.8822 9.23153 numMergedOcc 0
10 mol 220 unq 2 iso 0 dist 7.57712 5.25149 10.1832 6.19375 7.31105 5.39218 15.0279 14.6296 13.3213 9.23153 numMergedOcc 0
11 mol 220 unq 3 iso 0 dist 7.57712 5.25149 10.1832 6.19375 7.31105 5.39218 13.2107 9.52692 11.4842 8.24498 numMergedOcc 0
12 mol 220 unq 4 iso 0 dist 7.57712 8.6368 13.4455 6.19375 7.31105 14.3841 15.0279 14.6296 23.4423 9.23153 numMergedOcc 0
13 mol 220 unq 5 iso 0 dist 7.57712 8.6368 13.4455 6.19375 7.31105 14.3841 13.2107 9.52692 19.7557 8.24498 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 7.47122 7.03925 4.49347 15.4433 9.75313 12.6229 13.3678 6.46679 8.00193 6.61986 numMergedOcc 0
15 mol 224 unq 1 iso 0 dist 5.97988 8.81063 10.0093 6.70321 6.08709 14.4931 11.2702 7.85135 16.3597 6.61986 numMergedOcc 0
16 mol 224 unq 2 iso 0 dist 7.58998 6.23677 6.88745 6.87755 6.23882 7.49783 12.2287 15.0038 12.8561 8.95269 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 9.13126 4.71683 8.3795 5.52669 9.10613 9.44496 6.73134 6.0258 7.41812 8.04248 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 9.174 7.26758 10.9643 7.93809 9.72526 12.8359 6.40592 4.86437 7.3737 7.4631 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 8.57305 6.33567 5.00751 6.51074 5.81927 7.69358 10.3219 9.49027 9.80642 6.97229 numMergedOcc 0
20 mol 258 unq 1 iso 0 dist 7.70189 8.10903 5.27718 9.78068 8.58088 9.04358 14.0712 10.221 8.81588 6.60405 numMergedOcc 0
21 mol 258 unq 2 iso 0 dist 7.70189 8.10903 5.27718 9.78068 8.58088 9.04358 8.81059 9.22664 5.90131 6.42289 numMergedOcc 0
22 mol 258 unq 3 iso 0 dist 7.70189 7.25618 9.46467 9.78068 8.58088 10.0455 14.0712 10.221 11.1234 6.60405 numMergedOcc 0
23 mol 258 unq 4 iso 0 dist 7.70189 7.25618 9.46467 9.78068 8.58088 10.0455 8.81059 9.22664 4.51422 6.42289 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 4.55368 8.54422 6.14631 6.18571 7.93997 13.119 13.6279 14.8465 20.0871 7.46176 numMergedOcc 0
25 mol 259 unq 1 iso 0 dist 4.55368 7.67473 6.89689 6.18571 7.93997 10.895 13.6279 14.8465 17.4198 7.46176 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 6.23539 6.66936 5.95045 7.44724 6.90434 4.81916 14.2462 13.2927 7.94155 9.7748 numMergedOcc 0
