REMARK  Name = BDB055363
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.726  -0.348  -0.111  0.00  0.00    +0.066 A 
ATOM      2  N   LIG    1        2.253  -1.420  -0.805  0.00  0.00    -0.319 N 
ATOM      3  H   LIG    1        1.634  -2.099  -1.230  0.00  0.00    +0.169 HD
ATOM      4  C   LIG    1        3.606  -1.678  -0.952  0.00  0.00    +0.273 A 
ATOM      5  O   LIG    1        3.998  -2.657  -1.578  0.00  0.00    -0.266 OA
ATOM      6  C   LIG    1        4.469  -0.711  -0.316  0.00  0.00    +0.112 A 
ATOM      7  N   LIG    1        3.927   0.356   0.368  0.00  0.00    -0.315 N 
ATOM      8  C   LIG    1        4.946   1.124   0.875  0.00  0.00    +0.111 A 
ATOM      9  C   LIG    1        6.139   0.540   0.511  0.00  0.00    +0.060 A 
ATOM     10 CL   LIG    1        7.699   1.092   0.885  0.00  0.00    -0.082 Cl
ATOM     11  C   LIG    1        5.845  -0.619  -0.241  0.00  0.00    +0.053 A 
ATOM     12  C   LIG    1        2.555   0.538   0.471  0.00  0.00    +0.117 A 
ENDROOT
BRANCH   1  16
ATOM     13  C   LIG    1       -2.563   0.045   0.047  0.00  0.00    -0.017 A 
ATOM     14  C   LIG    1       -1.886  -0.033  -1.179  0.00  0.00    +0.007 A 
ATOM     15  C   LIG    1       -0.492  -0.162  -1.226  0.00  0.00    +0.010 A 
ATOM     16  C   LIG    1        0.264  -0.206  -0.049  0.00  0.00    -0.000 A 
ATOM     17  C   LIG    1       -0.399  -0.123   1.178  0.00  0.00    +0.010 A 
ATOM     18  C   LIG    1       -1.791   0.004   1.224  0.00  0.00    +0.007 A 
BRANCH  13  20
ATOM     19  C   LIG    1       -4.447   1.628   0.556  0.00  0.00    +0.046 C 
ATOM     20  C   LIG    1       -4.080   0.197   0.148  0.00  0.00    +0.085 C 
ATOM     21  C   LIG    1       -4.853  -0.185  -1.121  0.00  0.00    +0.046 C 
BRANCH  20  22
ATOM     22  O   LIG    1       -4.560  -0.679   1.178  0.00  0.00    -0.385 OA
ATOM     23  H   LIG    1       -4.109  -1.533   1.056  0.00  0.00    +0.211 HD
ENDBRANCH  20  22
ENDBRANCH  13  20
ENDBRANCH   1  16
TORSDOF 3