REMARK  Name = BDB064831
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        5.352  -0.775   1.282  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1        4.208  -0.729   0.839  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1        3.245   0.031   1.449  0.00  0.00    -0.253 N 
ATOM      4  H   LIG    1        3.591   0.592   2.216  0.00  0.00    +0.158 HD
ATOM      5  C   LIG    1        2.139   0.547   0.816  0.00  0.00    +0.266 C 
ATOM      6  O   LIG    1        1.660   1.620   1.179  0.00  0.00    -0.271 OA
ATOM      7  C   LIG    1        1.603  -0.269  -0.367  0.00  0.00    +0.219 C 
ATOM      8  O   LIG    1        0.940  -1.433   0.140  0.00  0.00    -0.377 OA
ATOM      9  N   LIG    1       -0.446  -1.168   0.191  0.00  0.00    -0.092 NA
ATOM     10  C   LIG    1       -0.657  -0.108  -0.520  0.00  0.00    +0.065 C 
ATOM     11  C   LIG    1        0.550   0.473  -1.163  0.00  0.00    +0.115 C 
ATOM     12  C   LIG    1        2.788  -0.704  -1.227  0.00  0.00    +0.070 C 
ATOM     13  C   LIG    1        3.787  -1.497  -0.392  0.00  0.00    +0.100 C 
ENDROOT
BRANCH  10  14
ATOM     14  C   LIG    1       -2.011   0.535  -0.698  0.00  0.00    +0.037 C 
ATOM     15  C   LIG    1       -2.291   1.505   0.459  0.00  0.00    +0.009 C 
ATOM     16  C   LIG    1       -3.658   1.113   1.008  0.00  0.00    +0.001 C 
ATOM     17  C   LIG    1       -3.766  -0.369   0.701  0.00  0.00    +0.001 C 
ATOM     18  C   LIG    1       -3.162  -0.477  -0.691  0.00  0.00    +0.009 C 
ENDBRANCH  10  14
TORSDOF 1