REMARK  Name = BDB016558
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.089  -0.114  -1.208  0.00  0.00    -0.337 N 
ATOM      2  H   LIG    1       -0.153  -1.044  -1.556  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   9
ATOM      3  C   LIG    1        5.463   0.696   0.356  0.00  0.00    +0.176 C 
ATOM      4  N   LIG    1        4.098   0.409  -0.046  0.00  0.00    -0.231 N 
ATOM      5  C   LIG    1        3.804  -0.778  -0.709  0.00  0.00    +0.287 A 
ATOM      6  O   LIG    1        4.645  -1.642  -0.955  0.00  0.00    -0.265 OA
ATOM      7  C   LIG    1        2.377  -0.956  -1.103  0.00  0.00    +0.129 A 
ATOM      8 CL   LIG    1        1.953  -2.460  -1.858  0.00  0.00    -0.076 Cl
ATOM      9  C   LIG    1        1.441  -0.021  -0.877  0.00  0.00    +0.071 A 
ATOM     10  C   LIG    1        1.977   1.206  -0.234  0.00  0.00    +0.157 A 
ATOM     11  N   LIG    1        3.191   1.417   0.156  0.00  0.00    -0.175 NA
ENDBRANCH   1   9
BRANCH   1  12
ATOM     12  C   LIG    1       -1.028   0.592  -0.579  0.00  0.00    +0.088 C 
ATOM     13  C   LIG    1       -1.259   0.095   0.868  0.00  0.00    +0.013 C 
ATOM     14  C   LIG    1       -1.701  -1.380   0.847  0.00  0.00    +0.021 C 
ATOM     15  C   LIG    1       -2.947  -1.532  -0.039  0.00  0.00    +0.085 C 
ATOM     16  N   LIG    1       -3.420  -0.228  -0.551  0.00  0.00    -0.301 NA
ATOM     17  C   LIG    1       -3.692   0.666   0.596  0.00  0.00    +0.085 C 
ATOM     18  C   LIG    1       -2.433   0.905   1.447  0.00  0.00    +0.021 C 
ATOM     19  C   LIG    1       -2.344   0.370  -1.382  0.00  0.00    +0.106 C 
ENDBRANCH   1  12
TORSDOF 2