REMARK  Name = BDB019719
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.097   0.774   1.208  0.00  0.00    +0.038 A 
ATOM      2  C   LIG    1        1.229   1.465   0.753  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1        2.512   0.917   0.904  0.00  0.00    -0.028 A 
ATOM      4  C   LIG    1        2.643  -0.341   1.510  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1        1.518  -1.018   1.977  0.00  0.00    +0.042 A 
ATOM      6 CL   LIG    1        1.698  -2.552   2.737  0.00  0.00    -0.084 Cl
ATOM      7  C   LIG    1        0.245  -0.467   1.838  0.00  0.00    +0.033 A 
ENDROOT
BRANCH   1  10
ATOM      8  N   LIG    1       -2.313   0.554   0.921  0.00  0.00    -0.305 N 
ATOM      9  H   LIG    1       -2.148  -0.433   0.779  0.00  0.00    +0.150 HD
ATOM     10  C   LIG    1       -1.237   1.408   1.024  0.00  0.00    +0.245 C 
ATOM     11  O   LIG    1       -1.328   2.627   0.940  0.00  0.00    -0.270 OA
BRANCH   8  13
ATOM     12  C   LIG    1       -4.267   1.697   1.910  0.00  0.00    +0.033 C 
ATOM     13  C   LIG    1       -3.656   1.050   0.663  0.00  0.00    +0.100 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -4.516  -0.080   0.122  0.00  0.00    -0.026 A 
ATOM     15  C   LIG    1       -4.884  -0.087  -1.233  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1       -5.655  -1.129  -1.750  0.00  0.00    +0.041 A 
ATOM     17 CL   LIG    1       -6.098  -1.119  -3.413  0.00  0.00    -0.084 Cl
ATOM     18  C   LIG    1       -6.065  -2.179  -0.933  0.00  0.00    +0.020 A 
ATOM     19  C   LIG    1       -5.699  -2.190   0.412  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1       -4.927  -1.150   0.935  0.00  0.00    +0.005 A 
ENDBRANCH  13  14
ENDBRANCH   8  13
ENDBRANCH   1  10
BRANCH   3  21
ATOM     21  C   LIG    1        3.727   1.646   0.386  0.00  0.00    +0.139 C 
BRANCH  21  22
ATOM     22  N   LIG    1        3.987   1.252  -0.983  0.00  0.00    -0.313 N 
ATOM     23  H   LIG    1        4.004   2.029  -1.631  0.00  0.00    +0.149 HD
BRANCH  22  24
ATOM     24  C   LIG    1        4.888   0.291  -1.281  0.00  0.00    +0.176 C 
ATOM     25  N   LIG    1        5.119   0.156  -2.614  0.00  0.00    -0.316 N 
ATOM     26  H   LIG    1        4.276   0.218  -3.172  0.00  0.00    +0.149 HD
ATOM     27  C   LIG    1        5.867  -1.073  -2.786  0.00  0.00    +0.127 C 
ATOM     28  C   LIG    1        6.364  -1.333  -1.361  0.00  0.00    +0.163 C 
ATOM     29  N   LIG    1        5.511  -0.505  -0.466  0.00  0.00    -0.255 NA
ENDBRANCH  22  24
ENDBRANCH  21  22
ENDBRANCH   3  21
TORSDOF 6