REMARK  Name = BDB060371
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        6.245  -0.099   2.089  0.00  0.00    -0.266 OA
ATOM      2  C   LIG    1        5.056  -0.090   1.754  0.00  0.00    +0.273 A 
ATOM      3  C   LIG    1        4.641   0.897   0.745  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1        3.322   0.976   0.301  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        2.959   1.921  -0.663  0.00  0.00    +0.051 A 
ATOM      6  C   LIG    1        3.882   2.815  -1.212  0.00  0.00    +0.064 A 
ATOM      7  C   LIG    1        5.197   2.723  -0.755  0.00  0.00    +0.126 A 
ATOM      8  F   LIG    1        6.114   3.560  -1.256  0.00  0.00    -0.205 F 
ATOM      9  N   LIG    1        1.609   1.762  -0.906  0.00  0.00    -0.356 N 
ATOM     10  H   LIG    1        1.076   2.314  -1.566  0.00  0.00    +0.166 HD
ATOM     11  C   LIG    1        1.124   0.747  -0.126  0.00  0.00    +0.044 A 
ATOM     12  C   LIG    1       -0.281   0.273  -0.110  0.00  0.00    +0.162 C 
ATOM     13  N   LIG    1       -0.320  -1.061   0.493  0.00  0.00    -0.289 N 
ATOM     14  C   LIG    1       -1.422  -1.905   0.336  0.00  0.00    +0.227 C 
ATOM     15  O   LIG    1       -1.624  -2.877   1.060  0.00  0.00    -0.275 OA
ATOM     16  C   LIG    1        0.529  -1.319   1.675  0.00  0.00    +0.166 C 
ATOM     17  C   LIG    1        1.975  -0.812   1.553  0.00  0.00    +0.088 A 
ATOM     18  N   LIG    1        2.895  -1.335   2.299  0.00  0.00    -0.174 NA
ATOM     19  C   LIG    1        2.169   0.260   0.628  0.00  0.00    +0.030 A 
ATOM     20  C   LIG    1        5.582   1.790   0.201  0.00  0.00    +0.052 A 
ATOM     21  N   LIG    1        4.216  -1.006   2.353  0.00  0.00    -0.242 N 
ATOM     22  H   LIG    1        4.728  -1.583   3.018  0.00  0.00    +0.192 HD
ENDROOT
BRANCH  14  23
ATOM     23  C   LIG    1       -2.414  -1.613  -0.775  0.00  0.00    +0.072 C 
ATOM     24  C   LIG    1       -1.957  -1.818  -2.219  0.00  0.00    +0.022 C 
ATOM     25  C   LIG    1       -2.863  -2.829  -1.601  0.00  0.00    +0.022 C 
BRANCH  23  26
ATOM     26  C   LIG    1       -3.525  -0.611  -0.444  0.00  0.00    -0.032 A 
ATOM     27  C   LIG    1       -3.672   0.614  -1.120  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -4.688   1.515  -0.789  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.584   1.211   0.230  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.466   0.006   0.916  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -4.450  -0.891   0.580  0.00  0.00    +0.004 A 
ENDBRANCH  23  26
ENDBRANCH  14  23
TORSDOF 2