REMARK  Name = BDB033032
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.180  -0.848  -1.094  0.00  0.00    +0.099 C 
ATOM      2  C   LIG    1       -0.073  -0.022  -0.794  0.00  0.00    +0.130 C 
ATOM      3  N   LIG    1       -0.928  -0.967  -0.106  0.00  0.00    -0.295 N 
ATOM      4  C   LIG    1       -0.608  -2.275  -0.434  0.00  0.00    +0.218 C 
ATOM      5  O   LIG    1       -1.225  -3.277  -0.114  0.00  0.00    -0.276 OA
ATOM      6  C   LIG    1        0.623  -2.255  -1.309  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1   9
ATOM      7  O   LIG    1        2.982   1.225  -0.577  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.955   0.280   0.204  0.00  0.00    +0.246 C 
ATOM      9  N   LIG    1        2.134  -0.815   0.017  0.00  0.00    -0.306 N 
ATOM     10  H   LIG    1        2.147  -1.589   0.668  0.00  0.00    +0.149 HD
BRANCH   8  11
ATOM     11  C   LIG    1        3.843   0.274   1.389  0.00  0.00    +0.055 A 
ATOM     12  C   LIG    1        3.534  -0.406   2.559  0.00  0.00    +0.123 A 
ATOM     13  N   LIG    1        4.332  -0.428   3.656  0.00  0.00    -0.263 NA
ATOM     14  C   LIG    1        5.481   0.280   3.586  0.00  0.00    +0.111 A 
ATOM     15  C   LIG    1        5.869   1.008   2.473  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1        5.032   1.006   1.358  0.00  0.00    +0.016 A 
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   3  17
ATOM     17  C   LIG    1       -2.161  -0.583   0.553  0.00  0.00    +0.145 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -3.276  -0.307  -0.427  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -3.620   0.977  -0.880  0.00  0.00    +0.131 A 
ATOM     20  C   LIG    1       -4.629   1.192  -1.830  0.00  0.00    +0.033 A 
ATOM     21  C   LIG    1       -5.324   0.100  -2.341  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -5.006  -1.188  -1.910  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -3.993  -1.390  -0.967  0.00  0.00    +0.007 A 
BRANCH  19  24
ATOM     24  N   LIG    1       -2.925   2.147  -0.382  0.00  0.00    +0.057 N 
ATOM     25  O   LIG    1       -2.202   2.752  -1.183  0.00  0.00    -0.126 OA
ATOM     26  O   LIG    1       -3.109   2.451   0.804  0.00  0.00    -0.126 OA
ENDBRANCH  19  24
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 5