REMARK  Name = BDB021932
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.839   0.449  -0.803  0.00  0.00    -0.296 N 
ATOM      2  H   LIG    1        0.983  -0.457  -1.224  0.00  0.00    +0.151 HD
ATOM      3  C   LIG    1        1.953   0.998  -0.195  0.00  0.00    +0.304 C 
ATOM      4  N   LIG    1        3.103   0.590  -0.838  0.00  0.00    -0.269 N 
ATOM      5  H   LIG    1        2.956   0.176  -1.746  0.00  0.00    +0.156 HD
ATOM      6  O   LIG    1        1.879   1.748   0.768  0.00  0.00    -0.253 OA
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        4.434   0.867  -0.470  0.00  0.00    +0.036 A 
ATOM      8  C   LIG    1        5.441   0.487  -1.367  0.00  0.00    +0.044 A 
ATOM      9  C   LIG    1        6.789   0.721  -1.069  0.00  0.00    +0.061 A 
ATOM     10 CL   LIG    1        7.965   0.223  -2.234  0.00  0.00    -0.082 Cl
ATOM     11  C   LIG    1        7.143   1.336   0.135  0.00  0.00    +0.059 A 
ATOM     12 CL   LIG    1        8.783   1.655   0.570  0.00  0.00    -0.082 Cl
ATOM     13  C   LIG    1        6.143   1.710   1.034  0.00  0.00    +0.023 A 
ATOM     14  C   LIG    1        4.797   1.475   0.733  0.00  0.00    +0.025 A 
ENDBRANCH   4   7
BRANCH   1  18
ATOM     15  N   LIG    1       -2.839  -1.171   0.003  0.00  0.00    -0.302 NA
ATOM     16  C   LIG    1       -2.896   0.090  -0.754  0.00  0.00    +0.086 C 
ATOM     17  C   LIG    1       -1.546   0.449  -1.367  0.00  0.00    +0.037 C 
ATOM     18  C   LIG    1       -0.501   0.702  -0.274  0.00  0.00    +0.077 C 
ATOM     19  C   LIG    1       -0.784  -0.119   0.994  0.00  0.00    +0.037 C 
ATOM     20  C   LIG    1       -1.545  -1.401   0.665  0.00  0.00    +0.086 C 
BRANCH  15  21
ATOM     21  C   LIG    1       -3.962  -1.309   0.946  0.00  0.00    +0.084 C 
BRANCH  21  23
ATOM     22  C   LIG    1       -6.452  -1.567   1.259  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -5.335  -1.299   0.261  0.00  0.00    +0.012 C 
ENDBRANCH  21  23
ENDBRANCH  15  21
ENDBRANCH   1  18
TORSDOF 4