REMARK  Name = BDB016593
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.270   1.076  -0.914  0.00  0.00    +0.084 C 
ATOM      2  C   LIG    1       -0.335  -0.009   0.019  0.00  0.00    +0.107 C 
ATOM      3  N   LIG    1       -1.800  -0.047  -0.081  0.00  0.00    -0.293 NA
ATOM      4  C   LIG    1       -2.392   1.204   0.443  0.00  0.00    +0.085 C 
ATOM      5  C   LIG    1       -1.512   2.446   0.236  0.00  0.00    +0.017 C 
ATOM      6  C   LIG    1       -0.640   2.316  -1.007  0.00  0.00    +0.025 C 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        1.588   1.490  -0.423  0.00  0.00    -0.337 N 
ATOM      8  H   LIG    1        1.545   2.117   0.384  0.00  0.00    +0.146 HD
BRANCH   7  15
ATOM      9  C   LIG    1        6.140  -1.844  -0.802  0.00  0.00    +0.176 C 
ATOM     10  N   LIG    1        4.992  -0.972  -0.629  0.00  0.00    -0.231 N 
ATOM     11  C   LIG    1        5.016   0.022   0.343  0.00  0.00    +0.287 A 
ATOM     12  O   LIG    1        5.961   0.194   1.112  0.00  0.00    -0.265 OA
ATOM     13  C   LIG    1        3.798   0.879   0.413  0.00  0.00    +0.129 A 
ATOM     14 CL   LIG    1        3.749   2.072   1.673  0.00  0.00    -0.076 Cl
ATOM     15  C   LIG    1        2.762   0.737  -0.429  0.00  0.00    +0.071 A 
ATOM     16  C   LIG    1        2.978  -0.316  -1.455  0.00  0.00    +0.157 A 
ATOM     17  N   LIG    1        3.991  -1.112  -1.556  0.00  0.00    -0.175 NA
ENDBRANCH   7  15
ENDBRANCH   1   7
BRANCH   3  18
ATOM     18  C   LIG    1       -2.340  -1.223   0.635  0.00  0.00    +0.158 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -3.798  -1.436   0.374  0.00  0.00    +0.121 A 
ATOM     20  N   LIG    1       -4.319  -1.427  -0.897  0.00  0.00    -0.347 N 
ATOM     21  H   LIG    1       -3.784  -1.246  -1.735  0.00  0.00    +0.167 HD
ATOM     22  C   LIG    1       -5.662  -1.651  -0.802  0.00  0.00    +0.104 A 
ATOM     23  C   LIG    1       -5.905  -1.792   0.543  0.00  0.00    +0.130 A 
ATOM     24  N   LIG    1       -4.747  -1.655   1.264  0.00  0.00    -0.239 NA
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 4