REMARK  Name = BDB016565
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.889   0.325  -0.665  0.00  0.00    +0.005 C 
ATOM      2  C   LIG    1        1.627  -1.170  -0.372  0.00  0.00    +0.087 C 
ATOM      3  N   LIG    1        0.862  -1.315   0.867  0.00  0.00    -0.303 NA
ATOM      4  C   LIG    1        0.839  -2.696   1.337  0.00  0.00    +0.105 C 
ATOM      5  C   LIG    1       -0.506  -0.779   0.721  0.00  0.00    +0.106 C 
ATOM      6  C   LIG    1       -0.637   0.371  -0.316  0.00  0.00    +0.085 C 
ATOM      7  C   LIG    1        0.652   1.198  -0.338  0.00  0.00    +0.028 C 
ENDROOT
BRANCH   6   8
ATOM      8  N   LIG    1       -1.766   1.248   0.001  0.00  0.00    -0.337 N 
ATOM      9  H   LIG    1       -1.581   1.866   0.795  0.00  0.00    +0.146 HD
BRANCH   8  10
ATOM     10  C   LIG    1       -3.122   0.927  -0.088  0.00  0.00    +0.071 A 
ATOM     11  C   LIG    1       -4.112   1.456   0.647  0.00  0.00    +0.129 A 
ATOM     12 CL   LIG    1       -3.768   2.646   1.863  0.00  0.00    -0.076 Cl
ATOM     13  C   LIG    1       -5.538   1.046   0.490  0.00  0.00    +0.287 A 
ATOM     14  O   LIG    1       -6.428   1.569   1.159  0.00  0.00    -0.265 OA
ATOM     15  N   LIG    1       -5.772   0.040  -0.441  0.00  0.00    -0.231 N 
ATOM     16  C   LIG    1       -7.128  -0.413  -0.693  0.00  0.00    +0.176 C 
ATOM     17  N   LIG    1       -4.806  -0.480  -1.264  0.00  0.00    -0.175 NA
ATOM     18  C   LIG    1       -3.597  -0.058  -1.093  0.00  0.00    +0.157 A 
ENDBRANCH   8  10
ENDBRANCH   6   8
BRANCH   1  19
ATOM     19  C   LIG    1        3.119   0.902   0.074  0.00  0.00    +0.008 C 
BRANCH  19  21
ATOM     20  C   LIG    1        5.477   1.342  -0.731  0.00  0.00    +0.007 C 
ATOM     21  C   LIG    1        4.463   0.262  -0.342  0.00  0.00    -0.017 C 
ATOM     22  C   LIG    1        5.044  -0.592   0.788  0.00  0.00    +0.007 C 
ENDBRANCH  19  21
ENDBRANCH   1  19
TORSDOF 4