REMARK  Name = BDB032059
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.243   2.289   1.080  0.00  0.00    +0.217 C 
ENDROOT
BRANCH   1   9
ATOM      2  C   LIG    1       -3.986  -2.393  -1.713  0.00  0.00    +0.152 C 
ATOM      3  N   LIG    1       -3.194  -1.483  -0.904  0.00  0.00    -0.318 N 
ATOM      4  C   LIG    1       -2.985  -1.793   0.461  0.00  0.00    +0.260 A 
ATOM      5  O   LIG    1       -3.428  -2.790   1.023  0.00  0.00    -0.267 OA
ATOM      6  C   LIG    1       -2.174  -0.807   1.167  0.00  0.00    +0.064 A 
ATOM      7  C   LIG    1       -1.725  -0.715   2.505  0.00  0.00    +0.033 A 
ATOM      8  C   LIG    1       -0.986   0.448   2.607  0.00  0.00    +0.087 A 
ATOM      9  N   LIG    1       -0.963   1.058   1.369  0.00  0.00    -0.338 N 
ATOM     10  C   LIG    1       -1.696   0.301   0.499  0.00  0.00    +0.056 A 
ATOM     11  C   LIG    1       -1.929   0.578  -0.864  0.00  0.00    +0.044 A 
ATOM     12  C   LIG    1       -2.675  -0.334  -1.515  0.00  0.00    +0.091 A 
ENDBRANCH   1   9
BRANCH   1  13
ATOM     13  C   LIG    1        0.937   2.090   0.143  0.00  0.00    +0.237 C 
ATOM     14  N   LIG    1        1.749   1.017   0.462  0.00  0.00    -0.283 N 
ATOM     15  H   LIG    1        1.446   0.405   1.217  0.00  0.00    +0.155 HD
ATOM     16  O   LIG    1        1.131   2.884  -0.776  0.00  0.00    -0.274 OA
BRANCH  14  17
ATOM     17  C   LIG    1        2.928   0.587  -0.198  0.00  0.00    +0.055 A 
ATOM     18  C   LIG    1        3.558  -0.581   0.257  0.00  0.00    +0.080 A 
ATOM     19 CL   LIG    1        2.937  -1.489   1.587  0.00  0.00    -0.080 Cl
ATOM     20  C   LIG    1        4.711  -1.010  -0.383  0.00  0.00    +0.132 A 
ATOM     21  N   LIG    1        5.275  -0.365  -1.429  0.00  0.00    -0.262 NA
ATOM     22  C   LIG    1        4.653   0.757  -1.850  0.00  0.00    +0.112 A 
ATOM     23  C   LIG    1        3.496   1.265  -1.275  0.00  0.00    +0.044 A 
ENDBRANCH  14  17
ENDBRANCH   1  13
TORSDOF 3