REMARK  Name = BDB032055
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.019  -1.733  -1.890  0.00  0.00    +0.217 C 
ENDROOT
BRANCH   1   9
ATOM      2  C   LIG    1       -4.589   1.027   1.967  0.00  0.00    +0.152 C 
ATOM      3  N   LIG    1       -3.620   0.595   0.976  0.00  0.00    -0.318 N 
ATOM      4  C   LIG    1       -3.424   1.393  -0.177  0.00  0.00    +0.260 A 
ATOM      5  O   LIG    1       -4.022   2.441  -0.406  0.00  0.00    -0.267 OA
ATOM      6  C   LIG    1       -2.426   0.859  -1.097  0.00  0.00    +0.064 A 
ATOM      7  C   LIG    1       -1.923   1.314  -2.337  0.00  0.00    +0.033 A 
ATOM      8  C   LIG    1       -0.983   0.393  -2.758  0.00  0.00    +0.087 A 
ATOM      9  N   LIG    1       -0.892  -0.602  -1.806  0.00  0.00    -0.338 N 
ATOM     10  C   LIG    1       -1.778  -0.323  -0.802  0.00  0.00    +0.056 A 
ATOM     11  C   LIG    1       -2.002  -1.093   0.357  0.00  0.00    +0.044 A 
ATOM     12  C   LIG    1       -2.921  -0.598   1.207  0.00  0.00    +0.091 A 
ENDBRANCH   1   9
BRANCH   1  13
ATOM     13  C   LIG    1        1.110  -1.705  -0.834  0.00  0.00    +0.237 C 
ATOM     14  N   LIG    1        1.771  -0.495  -0.733  0.00  0.00    -0.283 N 
ATOM     15  H   LIG    1        1.417   0.284  -1.285  0.00  0.00    +0.155 HD
ATOM     16  O   LIG    1        1.369  -2.722  -0.194  0.00  0.00    -0.274 OA
BRANCH  14  17
ATOM     17  C   LIG    1        2.844  -0.150   0.124  0.00  0.00    +0.052 A 
ATOM     18  C   LIG    1        3.317   1.177   0.098  0.00  0.00    +0.062 A 
ATOM     19 CL   LIG    1        2.606   2.353  -0.957  0.00  0.00    -0.082 Cl
ATOM     20  C   LIG    1        4.372   1.584   0.919  0.00  0.00    +0.022 A 
ATOM     21  C   LIG    1        4.973   0.667   1.778  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        4.518  -0.649   1.812  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1        3.460  -1.056   0.991  0.00  0.00    +0.025 A 
ENDBRANCH  14  17
ENDBRANCH   1  13
TORSDOF 3