REMARK  Name = BDB029463
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.889  -0.332   1.607  0.00  0.00    +0.132 C 
ATOM      2  N   LIG    1        1.891  -0.307   0.562  0.00  0.00    -0.304 N 
ATOM      3  C   LIG    1        2.196  -0.459  -0.780  0.00  0.00    +0.216 C 
ATOM      4  O   LIG    1        3.282  -0.753  -1.250  0.00  0.00    -0.276 OA
ATOM      5  C   LIG    1        0.967  -0.121  -1.587  0.00  0.00    +0.113 C 
ATOM      6  C   LIG    1       -0.155   0.001  -0.540  0.00  0.00    +0.072 C 
ATOM      7  C   LIG    1       -0.949  -1.296  -0.413  0.00  0.00    +0.227 C 
ATOM      8  O   LIG    1       -0.584  -2.371  -0.878  0.00  0.00    -0.275 OA
ATOM      9  N   LIG    1       -2.133  -1.211   0.278  0.00  0.00    -0.256 N 
ATOM     10  H   LIG    1       -2.642  -2.085   0.337  0.00  0.00    +0.157 HD
ATOM     11  C   LIG    1       -2.935  -0.101   0.344  0.00  0.00    +0.219 C 
ATOM     12  O   LIG    1       -4.132  -0.195   0.598  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -2.258   1.229   0.121  0.00  0.00    +0.097 C 
ATOM     14  C   LIG    1       -1.143   1.115  -0.909  0.00  0.00    +0.027 C 
ATOM     15  C   LIG    1        0.591   0.273   0.768  0.00  0.00    +0.124 C 
ENDROOT
TORSDOF 0