REMARK  Name = BDB063014
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.042  -0.768  -1.113  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -0.821  -0.151  -0.128  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1       -2.242  -0.171  -0.188  0.00  0.00    +0.020 A 
ATOM      4  C   LIG    1       -2.862  -0.843  -1.261  0.00  0.00    +0.073 A 
ATOM      5  N   LIG    1       -4.191  -0.923  -1.401  0.00  0.00    -0.251 NA
ATOM      6  C   LIG    1       -4.981  -0.329  -0.482  0.00  0.00    +0.047 A 
ATOM      7  C   LIG    1       -6.472  -0.476  -0.642  0.00  0.00    +0.056 C 
ATOM      8  C   LIG    1       -7.168   0.861  -0.407  0.00  0.00    +0.006 C 
ATOM      9  C   LIG    1       -6.674   1.612   0.837  0.00  0.00    +0.005 C 
ATOM     10  C   LIG    1       -5.503   0.950   1.572  0.00  0.00    +0.038 C 
ATOM     11  C   LIG    1       -4.493   0.375   0.614  0.00  0.00    -0.007 A 
ATOM     12  C   LIG    1       -2.072  -1.463  -2.218  0.00  0.00    +0.029 A 
ATOM     13  C   LIG    1       -3.104   0.435   0.763  0.00  0.00    +0.055 A 
ATOM     14 CL   LIG    1       -2.430   1.263   2.136  0.00  0.00    -0.083 Cl
ATOM     15  C   LIG    1       -0.676  -1.438  -2.156  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  17
ATOM     16  O   LIG    1        2.078  -1.670  -1.599  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1        1.446  -0.762  -1.071  0.00  0.00    +0.244 C 
ATOM     18  N   LIG    1        2.041   0.315  -0.447  0.00  0.00    -0.311 N 
ATOM     19  H   LIG    1        1.484   1.122  -0.202  0.00  0.00    +0.149 HD
BRANCH  18  20
ATOM     20  C   LIG    1        3.486   0.458  -0.417  0.00  0.00    +0.109 C 
BRANCH  20  21
ATOM     21  C   LIG    1        4.141  -0.463   0.615  0.00  0.00    +0.054 C 
BRANCH  21  22
ATOM     22  C   LIG    1        5.638  -0.280   0.656  0.00  0.00    -0.046 A 
ATOM     23  C   LIG    1        6.226   0.596   1.579  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1        7.611   0.775   1.598  0.00  0.00    +0.020 A 
ATOM     25  C   LIG    1        8.412   0.083   0.693  0.00  0.00    +0.041 A 
ATOM     26 CL   LIG    1       10.118   0.306   0.718  0.00  0.00    -0.084 Cl
ATOM     27  C   LIG    1        7.841  -0.788  -0.232  0.00  0.00    +0.020 A 
ATOM     28  C   LIG    1        6.456  -0.967  -0.252  0.00  0.00    +0.005 A 
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH  18  20
ENDBRANCH   1  17
TORSDOF 4