REMARK  Name = BDB061048
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.857  -0.159   0.311  0.00  0.00    +0.176 C 
ATOM      2  N   LIG    1        3.448   0.007   0.003  0.00  0.00    -0.231 N 
ATOM      3  C   LIG    1        2.995  -0.201  -1.297  0.00  0.00    +0.287 A 
ATOM      4  O   LIG    1        3.727  -0.563  -2.217  0.00  0.00    -0.265 OA
ATOM      5  C   LIG    1        1.537   0.027  -1.512  0.00  0.00    +0.129 A 
ATOM      6 CL   LIG    1        0.914  -0.310  -3.096  0.00  0.00    -0.076 Cl
ATOM      7  C   LIG    1        0.721   0.443  -0.532  0.00  0.00    +0.071 A 
ATOM      8  C   LIG    1        1.423   0.722   0.746  0.00  0.00    +0.157 A 
ATOM      9  N   LIG    1        2.672   0.518   1.011  0.00  0.00    -0.175 NA
ENDROOT
BRANCH   7  10
ATOM     10  N   LIG    1       -0.652   0.677  -0.627  0.00  0.00    -0.337 N 
ATOM     11  H   LIG    1       -0.998   0.399  -1.555  0.00  0.00    +0.146 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -1.636   0.269   0.388  0.00  0.00    +0.085 C 
ATOM     13  C   LIG    1       -2.067  -1.186   0.169  0.00  0.00    +0.103 C 
ATOM     14  N   LIG    1       -2.978  -1.085  -0.978  0.00  0.00    -0.314 NA
ATOM     15  H   LIG    1       -3.560  -1.917  -1.059  0.00  0.00    +0.122 HD
ATOM     16  C   LIG    1       -3.793   0.104  -0.721  0.00  0.00    +0.083 C 
ATOM     17  C   LIG    1       -2.939   1.031   0.144  0.00  0.00    +0.038 C 
ENDBRANCH  10  12
ENDBRANCH   7  10
TORSDOF 2