REMARK  Name = BDB032419
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.805  -0.362   0.187  0.00  0.00    +0.215 A 
ATOM      2  N   LIG    1       -0.731   0.779   0.903  0.00  0.00    -0.221 NA
ATOM      3  C   LIG    1        0.369   0.941   1.668  0.00  0.00    +0.115 A 
ATOM      4  C   LIG    1        1.394   0.013   1.755  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1        1.296  -1.167   1.011  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1        0.170  -1.347   0.203  0.00  0.00    +0.072 A 
ENDROOT
BRANCH   1   7
ATOM      7  O   LIG    1       -1.895  -0.599  -0.628  0.00  0.00    -0.476 OA
BRANCH   7   8
ATOM      8  C   LIG    1       -2.874   0.444  -0.580  0.00  0.00    +0.234 C 
BRANCH   8  13
ATOM      9  C   LIG    1       -7.706  -0.271  -0.861  0.00  0.00    +0.104 C 
ATOM     10  N   LIG    1       -6.588   0.067   0.016  0.00  0.00    -0.305 NA
ATOM     11  C   LIG    1       -5.623  -1.034   0.137  0.00  0.00    +0.084 C 
ATOM     12  C   LIG    1       -4.740  -1.228  -1.099  0.00  0.00    +0.022 C 
ATOM     13  C   LIG    1       -4.033   0.070  -1.524  0.00  0.00    +0.029 C 
ATOM     14  C   LIG    1       -5.059   1.207  -1.627  0.00  0.00    +0.022 C 
ATOM     15  C   LIG    1       -5.933   1.321  -0.374  0.00  0.00    +0.084 C 
ENDBRANCH   8  13
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   5  16
ATOM     16  C   LIG    1        2.395  -2.200   1.044  0.00  0.00    +0.137 C 
BRANCH  16  17
ATOM     17  N   LIG    1        3.441  -1.862   0.083  0.00  0.00    -0.340 N 
ATOM     18  H   LIG    1        3.038  -1.609  -0.816  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1        4.482  -0.999   0.445  0.00  0.00    +0.028 A 
ATOM     20  C   LIG    1        5.041  -0.164  -0.537  0.00  0.00    +0.031 A 
ATOM     21  C   LIG    1        6.118   0.699  -0.257  0.00  0.00    -0.013 A 
ATOM     22  C   LIG    1        6.673   0.702   1.034  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        7.741   1.570   1.274  0.00  0.00    +0.119 A 
ATOM     24  N   LIG    1        8.273   2.406   0.352  0.00  0.00    -0.263 NA
ATOM     25  C   LIG    1        7.718   2.376  -0.876  0.00  0.00    +0.111 A 
ATOM     26  C   LIG    1        6.152  -0.160   2.010  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1        6.659   1.553  -1.226  0.00  0.00    +0.028 A 
ATOM     28  C   LIG    1        5.079  -1.007   1.709  0.00  0.00    +0.023 A 
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH   5  16
TORSDOF 6