REMARK  Name = BDB055911
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.393  -1.342   0.463  0.00  0.00    +0.023 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        2.023  -0.898  -0.858  0.00  0.00    +0.075 C 
BRANCH   2  11
ATOM      3  O   LIG    1        6.487  -2.338  -0.439  0.00  0.00    -0.267 OA
ATOM      4  C   LIG    1        5.707  -1.393  -0.434  0.00  0.00    +0.259 A 
ATOM      5  C   LIG    1        6.149  -0.006  -0.214  0.00  0.00    +0.065 A 
ATOM      6  C   LIG    1        5.169   0.990  -0.230  0.00  0.00    +0.078 A 
ATOM      7  C   LIG    1        5.562   2.314  -0.023  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1        6.906   2.632   0.194  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1        7.873   1.625   0.207  0.00  0.00    +0.001 A 
ATOM     10  N   LIG    1        3.808   0.710  -0.444  0.00  0.00    -0.234 NA
ATOM     11  C   LIG    1        3.468  -0.522  -0.641  0.00  0.00    +0.110 A 
ATOM     12  C   LIG    1        7.497   0.298   0.002  0.00  0.00    +0.015 A 
ATOM     13  N   LIG    1        4.361  -1.560  -0.634  0.00  0.00    -0.310 N 
ATOM     14  H   LIG    1        4.057  -2.509  -0.794  0.00  0.00    +0.170 HD
ENDBRANCH   2  11
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -0.039  -1.869   0.296  0.00  0.00    +0.085 C 
BRANCH  15  16
ATOM     16  N   LIG    1       -0.944  -0.929  -0.372  0.00  0.00    -0.299 NA
ATOM     17  C   LIG    1       -1.294   0.247   0.456  0.00  0.00    +0.103 C 
ATOM     18  C   LIG    1       -2.691   0.220   1.124  0.00  0.00    +0.120 C 
ATOM     19  N   LIG    1       -3.757   0.007   0.130  0.00  0.00    -0.327 N 
ATOM     20  C   LIG    1       -3.365  -0.690  -1.105  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1       -2.163  -1.625  -0.842  0.00  0.00    +0.103 C 
BRANCH  19  22
ATOM     22  C   LIG    1       -5.045   0.472   0.332  0.00  0.00    +0.031 A 
ATOM     23  C   LIG    1       -5.530   0.778   1.615  0.00  0.00    +0.043 A 
ATOM     24  C   LIG    1       -6.833   1.246   1.815  0.00  0.00    +0.043 A 
ATOM     25 CL   LIG    1       -7.377   1.598   3.411  0.00  0.00    -0.083 Cl
ATOM     26  C   LIG    1       -7.695   1.426   0.741  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1       -7.246   1.133  -0.541  0.00  0.00    +0.003 A 
ATOM     28  C   LIG    1       -5.941   0.663  -0.735  0.00  0.00    +0.023 A 
ENDBRANCH  19  22
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 5