REMARK  Name = BDB057411
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.174  -0.894   0.376  0.00  0.00    +0.279 C 
ATOM      2  N   LIG    1        1.125  -0.383   0.129  0.00  0.00    -0.199 N 
ATOM      3  C   LIG    1        2.345  -1.051   0.115  0.00  0.00    +0.064 A 
ATOM      4  C   LIG    1        2.487  -2.502   0.401  0.00  0.00    +0.067 C 
ATOM      5  C   LIG    1        3.293  -0.105  -0.205  0.00  0.00    +0.085 A 
ATOM      6 CL   LIG    1        4.968  -0.315  -0.375  0.00  0.00    -0.080 Cl
ATOM      7  C   LIG    1        2.589   1.103  -0.370  0.00  0.00    +0.079 A 
ATOM      8  C   LIG    1        3.129   2.439  -0.723  0.00  0.00    +0.069 C 
ATOM      9  N   LIG    1        1.278   0.940  -0.167  0.00  0.00    -0.167 NA
ATOM     10  O   LIG    1       -0.290  -2.103   0.572  0.00  0.00    -0.265 OA
ENDROOT
BRANCH   1  13
ATOM     11  C   LIG    1       -2.595  -1.653  -1.184  0.00  0.00    +0.044 C 
ATOM     12  C   LIG    1       -2.554  -0.426  -0.316  0.00  0.00    -0.038 A 
ATOM     13  C   LIG    1       -1.404  -0.055   0.411  0.00  0.00    +0.044 A 
ATOM     14  C   LIG    1       -1.423   1.089   1.224  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1       -2.574   1.871   1.312  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -3.715   1.510   0.600  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -3.707   0.368  -0.204  0.00  0.00    +0.004 A 
ENDBRANCH   1  13
TORSDOF 1