REMARK  Name = BDB016578
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.670  -0.600  -0.065  0.00  0.00    +0.084 C 
ATOM      2  C   LIG    1       -0.632  -1.281   0.448  0.00  0.00    +0.107 C 
ATOM      3  N   LIG    1       -1.900  -0.786  -0.131  0.00  0.00    -0.295 NA
ATOM      4  C   LIG    1       -1.665   0.069  -1.302  0.00  0.00    +0.085 C 
ATOM      5  C   LIG    1       -0.747   1.264  -1.030  0.00  0.00    +0.017 C 
ATOM      6  C   LIG    1        0.460   0.912  -0.158  0.00  0.00    +0.025 C 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        1.782  -0.902   0.840  0.00  0.00    -0.337 N 
ATOM      8  H   LIG    1        1.559  -0.737   1.825  0.00  0.00    +0.146 HD
BRANCH   7  15
ATOM      9  C   LIG    1        7.183  -0.097  -0.641  0.00  0.00    +0.176 C 
ATOM     10  N   LIG    1        5.813  -0.267  -0.191  0.00  0.00    -0.231 N 
ATOM     11  C   LIG    1        5.524  -0.275   1.169  0.00  0.00    +0.287 A 
ATOM     12  O   LIG    1        6.375  -0.110   2.043  0.00  0.00    -0.265 OA
ATOM     13  C   LIG    1        4.090  -0.488   1.519  0.00  0.00    +0.129 A 
ATOM     14 CL   LIG    1        3.676  -0.422   3.204  0.00  0.00    -0.076 Cl
ATOM     15  C   LIG    1        3.142  -0.701   0.593  0.00  0.00    +0.071 A 
ATOM     16  C   LIG    1        3.673  -0.745  -0.794  0.00  0.00    +0.157 A 
ATOM     17  N   LIG    1        4.894  -0.544  -1.170  0.00  0.00    -0.175 NA
ENDBRANCH   7  15
ENDBRANCH   1   7
BRANCH   3  18
ATOM     18  C   LIG    1       -2.726  -0.122   0.903  0.00  0.00    +0.139 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -4.121   0.267   0.443  0.00  0.00    +0.055 A 
ATOM     20  N   LIG    1       -4.419   1.591   0.409  0.00  0.00    -0.259 NA
ATOM     21  C   LIG    1       -5.659   1.936  -0.005  0.00  0.00    +0.111 A 
ATOM     22  C   LIG    1       -6.625   1.023  -0.392  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1       -6.304  -0.328  -0.355  0.00  0.00    +0.003 A 
ATOM     24  C   LIG    1       -5.036  -0.716   0.067  0.00  0.00    +0.024 A 
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 4