REMARK  Name = BDB031344
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.967   1.110   0.215  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1       -3.864  -0.204  -0.248  0.00  0.00    +0.028 A 
ATOM      3  C   LIG    1       -2.607  -0.787  -0.330  0.00  0.00    -0.023 A 
ATOM      4  C   LIG    1       -2.255  -2.146  -0.831  0.00  0.00    +0.056 C 
ATOM      5  C   LIG    1       -0.796  -2.271  -0.353  0.00  0.00    +0.115 C 
ATOM      6  N   LIG    1       -0.288  -0.905  -0.126  0.00  0.00    -0.299 N 
ATOM      7  C   LIG    1       -1.444  -0.111   0.050  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1       -1.547   1.164   0.577  0.00  0.00    +0.025 A 
ATOM      9  C   LIG    1       -2.812   1.762   0.675  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1        1.075  -0.631   0.003  0.00  0.00    +0.036 A 
ATOM     11  C   LIG    1        1.586   0.642  -0.313  0.00  0.00    +0.051 A 
ATOM     12  C   LIG    1        2.939   0.855  -0.175  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1        3.807  -0.139   0.257  0.00  0.00    +0.067 A 
ATOM     14  N   LIG    1        5.091   0.391   0.284  0.00  0.00    -0.306 N 
ATOM     15  H   LIG    1        5.942  -0.076   0.551  0.00  0.00    +0.170 HD
ATOM     16  C   LIG    1        5.034   1.728  -0.138  0.00  0.00    +0.325 A 
ATOM     17  O   LIG    1        5.971   2.499  -0.240  0.00  0.00    -0.247 OA
ATOM     18  C   LIG    1        3.367  -1.398   0.570  0.00  0.00    +0.029 A 
ATOM     19  N   LIG    1        3.688   2.001  -0.422  0.00  0.00    -0.306 N 
ATOM     20  H   LIG    1        3.352   2.891  -0.749  0.00  0.00    +0.170 HD
ATOM     21  C   LIG    1        1.990  -1.635   0.434  0.00  0.00    +0.025 A 
ENDBRANCH   6  10
BRANCH   1  22
ATOM     22  N   LIG    1       -5.227   1.683   0.428  0.00  0.00    -0.358 N 
ATOM     23  H   LIG    1       -5.214   2.698   0.458  0.00  0.00    +0.142 HD
ATOM     24  H   LIG    1       -5.949   1.326  -0.190  0.00  0.00    +0.142 HD
ENDBRANCH   1  22
TORSDOF 2