REMARK  Name = BDB026675
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.582  -1.303   0.661  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        3.465   0.065   0.378  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.184   0.635   0.306  0.00  0.00    +0.090 A 
ATOM      4  N   LIG    1        1.849   1.935   0.066  0.00  0.00    -0.232 NA
ATOM      5  C   LIG    1        0.531   1.988   0.099  0.00  0.00    +0.116 A 
ATOM      6  N   LIG    1       -0.018   0.734   0.377  0.00  0.00    -0.296 N 
ATOM      7  C   LIG    1        1.052  -0.149   0.504  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        1.154  -1.510   0.839  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        2.436  -2.070   0.905  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1       -1.398   0.399   0.495  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -1.877  -0.793  -0.069  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -3.232  -1.133   0.046  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -3.790  -2.348  -0.642  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -4.999  -2.894   0.100  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -5.987  -1.807   0.453  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -5.458  -0.597   0.818  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1       -6.120   0.078   1.179  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -7.197  -2.010   0.508  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -4.103  -0.271   0.719  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1       -3.637   0.921   1.268  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1       -2.284   1.254   1.163  0.00  0.00    +0.028 A 
ENDBRANCH   6  10
BRANCH   1  25
ATOM     22  C   LIG    1        7.233  -2.033  -0.023  0.00  0.00    +0.128 C 
ATOM     23  N   LIG    1        5.941  -1.397   0.038  0.00  0.00    -0.314 N 
ATOM     24  H   LIG    1        5.723  -0.710  -0.671  0.00  0.00    +0.149 HD
ATOM     25  C   LIG    1        4.910  -1.971   0.753  0.00  0.00    +0.244 C 
ATOM     26  O   LIG    1        5.036  -2.998   1.412  0.00  0.00    -0.270 OA
ENDBRANCH   1  25
BRANCH   5  27
ATOM     27  C   LIG    1       -0.268   3.214  -0.237  0.00  0.00    +0.089 C 
BRANCH  27  28
ATOM     28  C   LIG    1        0.550   4.237  -1.034  0.00  0.00    +0.085 C 
BRANCH  28  29
ATOM     29  N   LIG    1       -0.271   5.391  -1.415  0.00  0.00    -0.330 NA
ATOM     30  H   LIG    1        0.320   6.068  -1.897  0.00  0.00    +0.118 HD
ATOM     31  H   LIG    1       -0.972   5.099  -2.096  0.00  0.00    +0.118 HD
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH   5  27
TORSDOF 5