REMARK  Name = BDB000700
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.643   2.125  -1.646  0.00  0.00    +0.069 C 
ATOM      2  C   LIG    1        2.220   0.865  -0.986  0.00  0.00    +0.079 A 
ATOM      3  C   LIG    1        2.992  -0.284  -0.729  0.00  0.00    +0.085 A 
ATOM      4 CL   LIG    1        4.626  -0.499  -1.129  0.00  0.00    -0.080 Cl
ATOM      5  C   LIG    1        2.146  -1.169  -0.098  0.00  0.00    +0.064 A 
ATOM      6  C   LIG    1        2.396  -2.542   0.411  0.00  0.00    +0.067 C 
ATOM      7  N   LIG    1        0.916  -0.526  -0.001  0.00  0.00    -0.199 N 
ATOM      8  C   LIG    1       -0.286  -0.980   0.599  0.00  0.00    +0.279 C 
ATOM      9  O   LIG    1       -0.254  -2.058   1.195  0.00  0.00    -0.265 OA
ATOM     10  N   LIG    1        0.965   0.722  -0.549  0.00  0.00    -0.167 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -1.586  -0.249   0.586  0.00  0.00    +0.041 A 
ATOM     12  C   LIG    1       -2.004   0.526  -0.503  0.00  0.00    +0.015 A 
ATOM     13  C   LIG    1       -3.245   1.171  -0.471  0.00  0.00    +0.021 A 
ATOM     14  C   LIG    1       -4.074   1.034   0.641  0.00  0.00    +0.041 A 
ATOM     15 CL   LIG    1       -5.599   1.828   0.674  0.00  0.00    -0.084 Cl
ATOM     16  C   LIG    1       -3.677   0.251   1.722  0.00  0.00    +0.021 A 
ATOM     17  C   LIG    1       -2.438  -0.394   1.693  0.00  0.00    +0.015 A 
ENDBRANCH   8  11
TORSDOF 1