REMARK  Name = BDB055029
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.894   0.509   0.260  0.00  0.00    -0.249 N 
ATOM      2  H   LIG    1       -0.537   1.304   0.783  0.00  0.00    +0.169 HD
ATOM      3  C   LIG    1       -0.020  -0.398  -0.327  0.00  0.00    +0.227 C 
ATOM      4  O   LIG    1       -0.343  -1.387  -0.977  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   1   6
ATOM      5  C   LIG    1       -2.894   1.446  -0.584  0.00  0.00    +0.127 C 
ATOM      6  N   LIG    1       -2.282   0.329   0.132  0.00  0.00    -0.233 NA
ATOM      7  C   LIG    1       -2.909   0.124   1.436  0.00  0.00    +0.127 C 
ENDBRANCH   1   6
BRANCH   3   8
ATOM      8  C   LIG    1        1.425  -0.029  -0.074  0.00  0.00    +0.108 C 
BRANCH   8   9
ATOM      9  C   LIG    1        2.373  -1.031  -0.723  0.00  0.00    +0.129 C 
BRANCH   9  10
ATOM     10  C   LIG    1        3.809  -0.661  -0.469  0.00  0.00    +0.305 C 
ATOM     11  O   LIG    1        4.181   0.311   0.169  0.00  0.00    -0.251 OA
BRANCH  10  12
ATOM     12  O   LIG    1        4.674  -1.534  -1.034  0.00  0.00    -0.481 OA
ATOM     13  H   LIG    1        4.236  -2.263  -1.515  0.00  0.00    +0.295 HD
ENDBRANCH  10  12
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   3   8
TORSDOF 5