REMARK  Name = BDB061050
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.164  -0.920  -0.568  0.00  0.00    -0.337 N 
ATOM      2  H   LIG    1       -0.145  -0.837  -1.537  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   9
ATOM      3  C   LIG    1        5.227   1.240   0.727  0.00  0.00    +0.176 C 
ATOM      4  N   LIG    1        3.929   0.727   0.326  0.00  0.00    -0.231 N 
ATOM      5  C   LIG    1        3.583   0.687  -1.021  0.00  0.00    +0.287 A 
ATOM      6  O   LIG    1        4.314   1.101  -1.920  0.00  0.00    -0.265 OA
ATOM      7  C   LIG    1        2.240   0.112  -1.321  0.00  0.00    +0.129 A 
ATOM      8 CL   LIG    1        1.738   0.118  -2.983  0.00  0.00    -0.076 Cl
ATOM      9  C   LIG    1        1.430  -0.374  -0.367  0.00  0.00    +0.071 A 
ATOM     10  C   LIG    1        2.021  -0.312   0.994  0.00  0.00    +0.157 A 
ATOM     11  N   LIG    1        3.163   0.192   1.329  0.00  0.00    -0.175 NA
ENDBRANCH   1   9
BRANCH   1  12
ATOM     12  C   LIG    1       -0.928  -1.061   0.401  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1       -2.000  -2.029  -0.162  0.00  0.00    +0.103 C 
ATOM     14  N   LIG    1       -2.811  -1.539  -1.281  0.00  0.00    -0.314 NA
ATOM     15  H   LIG    1       -2.230  -1.163  -2.026  0.00  0.00    +0.122 HD
ATOM     16  C   LIG    1       -3.808  -0.566  -0.855  0.00  0.00    +0.081 C 
ATOM     17  C   LIG    1       -3.337   0.883  -0.919  0.00  0.00    +0.015 C 
ATOM     18  C   LIG    1       -1.960   1.201  -0.337  0.00  0.00    +0.003 C 
ATOM     19  C   LIG    1       -1.489   0.311   0.815  0.00  0.00    +0.023 C 
ENDBRANCH   1  12
TORSDOF 2