REMARK  Name = BDB032216
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.486   0.911   0.989  0.00  0.00    +0.138 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1       -1.659   1.798   0.704  0.00  0.00    +0.215 A 
ATOM      3  N   LIG    1       -1.271   0.773   1.491  0.00  0.00    -0.221 NA
ATOM      4  C   LIG    1        0.057   0.523   1.554  0.00  0.00    +0.119 A 
ATOM      5  C   LIG    1        1.024   1.247   0.865  0.00  0.00    -0.012 A 
ATOM      6  C   LIG    1        0.582   2.302   0.061  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -0.778   2.583  -0.023  0.00  0.00    +0.067 A 
BRANCH   2   8
ATOM      8  O   LIG    1       -2.997   2.113   0.580  0.00  0.00    -0.476 OA
BRANCH   8   9
ATOM      9  C   LIG    1       -3.884   1.293   1.345  0.00  0.00    +0.234 C 
BRANCH   9  14
ATOM     10  C   LIG    1       -8.122  -0.524  -0.980  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1       -6.879  -1.073  -0.445  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1       -5.730  -0.789  -1.315  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1       -4.839   0.339  -0.801  0.00  0.00    +0.022 C 
ATOM     14  C   LIG    1       -4.268   0.008   0.590  0.00  0.00    +0.029 C 
ATOM     15  C   LIG    1       -5.243  -0.853   1.411  0.00  0.00    +0.022 C 
ATOM     16  C   LIG    1       -6.687  -0.658   0.952  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   8   9
ENDBRANCH   2   8
ENDBRANCH   1   5
BRANCH   1  17
ATOM     17  N   LIG    1        3.010   0.525  -0.316  0.00  0.00    -0.340 N 
ATOM     18  H   LIG    1        2.356  -0.048  -0.845  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1        4.327   0.071  -0.432  0.00  0.00    +0.029 A 
ATOM     20  C   LIG    1        5.334   0.348   0.502  0.00  0.00    +0.051 A 
ATOM     21  C   LIG    1        6.657  -0.054   0.334  0.00  0.00    +0.078 A 
ATOM     22  C   LIG    1        7.010  -0.737  -0.836  0.00  0.00    +0.040 A 
ATOM     23  C   LIG    1        8.362  -1.109  -0.931  0.00  0.00    +0.127 A 
ATOM     24  N   LIG    1        9.259  -0.833   0.022  0.00  0.00    -0.221 NA
ATOM     25  C   LIG    1        8.803  -0.174   1.090  0.00  0.00    +0.223 A 
ATOM     26  C   LIG    1        6.021  -0.991  -1.812  0.00  0.00    +0.015 A 
ATOM     27  N   LIG    1        7.543   0.231   1.294  0.00  0.00    -0.235 NA
ATOM     28  C   LIG    1        4.703  -0.577  -1.611  0.00  0.00    +0.024 A 
BRANCH  23  29
ATOM     29  N   LIG    1        8.855  -1.797  -2.053  0.00  0.00    -0.343 N 
ATOM     30  H   LIG    1        8.357  -2.675  -2.160  0.00  0.00    +0.144 HD
ATOM     31  H   LIG    1        8.708  -1.236  -2.887  0.00  0.00    +0.144 HD
ENDBRANCH  23  29
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7