REMARK  Name = BDB057422
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.860   0.835   2.123  0.00  0.00    +0.069 C 
ATOM      2  C   LIG    1       -2.218   0.214   0.938  0.00  0.00    +0.079 A 
ATOM      3  C   LIG    1       -2.825  -0.534  -0.089  0.00  0.00    +0.085 A 
ATOM      4 CL   LIG    1       -4.476  -0.909  -0.208  0.00  0.00    -0.080 Cl
ATOM      5  C   LIG    1       -1.808  -0.881  -0.951  0.00  0.00    +0.064 A 
ATOM      6  C   LIG    1       -1.842  -1.668  -2.211  0.00  0.00    +0.067 C 
ATOM      7  N   LIG    1       -0.645  -0.335  -0.415  0.00  0.00    -0.199 N 
ATOM      8  C   LIG    1        0.676  -0.364  -0.931  0.00  0.00    +0.279 C 
ATOM      9  O   LIG    1        0.841  -0.871  -2.043  0.00  0.00    -0.265 OA
ATOM     10  N   LIG    1       -0.900   0.333   0.746  0.00  0.00    -0.167 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        1.883   0.185  -0.252  0.00  0.00    +0.044 A 
ATOM     12  C   LIG    1        2.926   0.661  -1.052  0.00  0.00    +0.033 A 
ATOM     13  C   LIG    1        4.060   1.150  -0.429  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.217   1.188   0.910  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        3.203   0.708   1.661  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        2.031   0.194   1.134  0.00  0.00    +0.033 A 
ENDBRANCH   8  11
TORSDOF 1