REMARK  Name = BDB054804
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.303   0.461  -0.498  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        2.232  -0.632  -1.363  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        3.322  -1.361  -1.652  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.026  -1.005  -1.954  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -0.134  -0.280  -1.687  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -0.094   0.826  -0.828  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        1.128   1.183  -0.233  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        3.575   1.914   0.849  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        3.569   0.901   0.155  0.00  0.00    +0.247 C 
ATOM     10  N   LIG    1        4.695   0.129  -0.059  0.00  0.00    -0.308 N 
ATOM     11  H   LIG    1        4.626  -0.700  -0.639  0.00  0.00    +0.149 HD
BRANCH  10  12
ATOM     12  C   LIG    1        5.965   0.457   0.505  0.00  0.00    +0.073 C 
ATOM     13  C   LIG    1        7.205  -0.283   0.085  0.00  0.00    +0.024 C 
ATOM     14  C   LIG    1        7.011   1.147  -0.326  0.00  0.00    +0.024 C 
ENDBRANCH  10  12
ENDBRANCH   1   9
BRANCH   6  15
ATOM     15  C   LIG    1       -1.352   1.603  -0.513  0.00  0.00    +0.094 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -2.146   0.972   0.624  0.00  0.00    +0.087 A 
ATOM     17  C   LIG    1       -3.276   0.032   0.297  0.00  0.00    +0.059 A 
ATOM     18  N   LIG    1       -3.671  -0.203  -1.017  0.00  0.00    -0.342 N 
ATOM     19  H   LIG    1       -3.747   0.647  -1.572  0.00  0.00    +0.146 HD
ATOM     20  C   LIG    1       -4.692  -1.201  -1.325  0.00  0.00    +0.102 C 
ATOM     21  C   LIG    1       -5.725  -1.267  -0.205  0.00  0.00    +0.023 C 
ATOM     22  C   LIG    1       -5.047  -1.482   1.154  0.00  0.00    +0.044 C 
ATOM     23  C   LIG    1       -3.872  -0.564   1.342  0.00  0.00    +0.041 A 
ATOM     24  C   LIG    1       -3.430  -0.276   2.724  0.00  0.00    +0.270 A 
ATOM     25  O   LIG    1       -3.940  -0.831   3.692  0.00  0.00    -0.266 OA
ATOM     26  N   LIG    1       -2.438   0.659   2.855  0.00  0.00    -0.243 N 
ATOM     27  H   LIG    1       -2.114   0.866   3.794  0.00  0.00    +0.192 HD
ATOM     28  N   LIG    1       -1.774   1.267   1.835  0.00  0.00    -0.174 NA
ENDBRANCH  15  16
ENDBRANCH   6  15
TORSDOF 4