REMARK  Name = BDB029387
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -6.154  -1.596   1.067  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -5.070  -1.148   0.732  0.00  0.00    +0.222 C 
ATOM      3  N   LIG    1       -3.842  -1.777   0.901  0.00  0.00    -0.285 N 
ATOM      4  H   LIG    1       -3.749  -2.690   1.322  0.00  0.00    +0.155 HD
ATOM      5  C   LIG    1       -2.806  -0.998   0.413  0.00  0.00    +0.038 A 
ATOM      6  C   LIG    1       -3.315   0.193  -0.102  0.00  0.00    -0.017 A 
ATOM      7  C   LIG    1       -2.478   1.140  -0.661  0.00  0.00    +0.006 A 
ATOM      8  C   LIG    1       -1.105   0.868  -0.684  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1       -0.597  -0.336  -0.141  0.00  0.00    +0.039 A 
ATOM     10  C   LIG    1       -1.461  -1.295   0.405  0.00  0.00    +0.036 A 
ATOM     11  C   LIG    1       -4.808   0.202   0.054  0.00  0.00    +0.133 C 
ENDROOT
BRANCH   9  12
ATOM     12  C   LIG    1        0.861  -0.642  -0.162  0.00  0.00    +0.248 C 
ATOM     13  N   LIG    1        1.688   0.446   0.055  0.00  0.00    -0.281 N 
ATOM     14  H   LIG    1        1.245   1.318   0.312  0.00  0.00    +0.155 HD
ATOM     15  O   LIG    1        1.206  -1.805  -0.330  0.00  0.00    -0.270 OA
BRANCH  13  16
ATOM     16  C   LIG    1        3.101   0.454   0.051  0.00  0.00    +0.037 A 
ATOM     17  C   LIG    1        3.884  -0.650  -0.269  0.00  0.00    +0.043 A 
ATOM     18  C   LIG    1        5.263  -0.512  -0.242  0.00  0.00    +0.112 A 
ATOM     19  N   LIG    1        5.901   0.635   0.074  0.00  0.00    -0.263 NA
ATOM     20  C   LIG    1        5.122   1.692   0.378  0.00  0.00    +0.112 A 
ATOM     21  C   LIG    1        3.737   1.653   0.379  0.00  0.00    +0.043 A 
ENDBRANCH  13  16
ENDBRANCH   9  12
TORSDOF 2