REMARK  Name = BDB032704
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.473   1.038   0.204  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -2.727   0.056  -0.424  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.007  -1.114  -0.585  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.509   0.702  -0.927  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.602   2.066  -0.659  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1       -0.583   2.922  -1.033  0.00  0.00    +0.006 A 
ATOM      7  C   LIG    1        0.531   2.376  -1.683  0.00  0.00    +0.007 A 
ATOM      8  C   LIG    1        0.617   0.991  -1.964  0.00  0.00    -0.010 A 
ATOM      9  C   LIG    1       -0.423   0.137  -1.569  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -2.895   2.362   0.021  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -6.942  -2.673   0.130  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -6.283  -1.653   0.317  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -6.452  -0.560  -0.492  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -7.087  -0.690  -1.267  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.805   0.648  -0.444  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -5.983   1.490  -1.325  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -4.830   0.873   0.712  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -4.994  -0.127   1.854  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -5.252  -1.555   1.412  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   8  20
ATOM     20  C   LIG    1        1.839   0.433  -2.650  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.908   0.333  -1.703  0.00  0.00    -0.445 OA
BRANCH  21  22
ATOM     22  C   LIG    1        3.099  -0.894  -1.151  0.00  0.00    +0.403 C 
ATOM     23  N   LIG    1        4.137  -0.905  -0.225  0.00  0.00    -0.267 N 
ATOM     24  C   LIG    1        4.281  -2.097   0.603  0.00  0.00    +0.111 C 
ATOM     25  C   LIG    1        5.708  -2.284   1.107  0.00  0.00    +0.019 C 
ATOM     26  C   LIG    1        6.230  -1.017   1.775  0.00  0.00    +0.003 C 
ATOM     27  C   LIG    1        6.114   0.167   0.822  0.00  0.00    +0.019 C 
ATOM     28  C   LIG    1        4.685   0.338   0.313  0.00  0.00    +0.111 C 
ATOM     29  O   LIG    1        2.431  -1.881  -1.438  0.00  0.00    -0.226 OA
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   8  20
TORSDOF 4