REMARK  Name = BDB000927
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.598   0.104   0.057  0.00  0.00    +0.062 A 
ATOM      2  C   LIG    1        1.203   0.004   0.129  0.00  0.00    +0.078 A 
ATOM      3  C   LIG    1        0.538  -0.369   1.291  0.00  0.00    +0.090 A 
ATOM      4  N   LIG    1       -0.821  -0.381   1.095  0.00  0.00    -0.232 NA
ATOM      5  C   LIG    1       -0.997  -0.060  -0.168  0.00  0.00    +0.114 A 
ATOM      6  C   LIG    1        1.280  -0.673   2.443  0.00  0.00    +0.030 A 
ATOM      7  C   LIG    1        2.678  -0.611   2.386  0.00  0.00    +0.003 A 
ATOM      8  N   LIG    1        0.200   0.170  -0.793  0.00  0.00    -0.341 N 
ATOM      9  H   LIG    1        0.329   0.397  -1.770  0.00  0.00    +0.167 HD
ATOM     10  C   LIG    1        3.327  -0.233   1.208  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  14
ATOM     11  N   LIG    1        2.688   1.476  -1.935  0.00  0.00    -0.325 N 
ATOM     12  H   LIG    1        3.288   1.866  -2.655  0.00  0.00    +0.145 HD
ATOM     13  H   LIG    1        2.075   2.139  -1.477  0.00  0.00    +0.145 HD
ATOM     14  C   LIG    1        3.306   0.524  -1.168  0.00  0.00    +0.244 C 
ATOM     15  O   LIG    1        4.409   0.086  -1.462  0.00  0.00    -0.270 OA
ENDBRANCH   1  14
BRANCH   5  16
ATOM     16  C   LIG    1       -2.379   0.032  -0.871  0.00  0.00    +0.082 C 
ATOM     17  C   LIG    1       -3.507   0.696  -0.053  0.00  0.00    +0.093 C 
ATOM     18  N   LIG    1       -4.433  -0.325  -0.611  0.00  0.00    -0.315 NA
ATOM     19  H   LIG    1       -5.134  -0.658   0.050  0.00  0.00    +0.122 HD
ATOM     20  C   LIG    1       -3.263  -1.228  -0.765  0.00  0.00    +0.093 C 
ENDBRANCH   5  16
TORSDOF 2