REMARK  Name = BDB031283
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.230   0.220   0.301  0.00  0.00    +0.057 A 
ATOM      2  C   LIG    1       -2.243   1.154   0.061  0.00  0.00    +0.044 A 
ATOM      3  C   LIG    1       -3.502   0.635  -0.101  0.00  0.00    +0.087 A 
ATOM      4  C   LIG    1       -3.728  -0.737  -0.014  0.00  0.00    +0.158 A 
ATOM      5  N   LIG    1       -5.080  -0.950  -0.222  0.00  0.00    -0.291 N 
ATOM      6  H   LIG    1       -5.535  -1.846  -0.206  0.00  0.00    +0.172 HD
ATOM      7  C   LIG    1       -5.710   0.280  -0.433  0.00  0.00    +0.326 A 
ATOM      8  O   LIG    1       -6.894   0.466  -0.642  0.00  0.00    -0.247 OA
ATOM      9  N   LIG    1       -2.798  -1.663   0.231  0.00  0.00    -0.235 NA
ATOM     10  N   LIG    1       -4.714   1.265  -0.358  0.00  0.00    -0.305 N 
ATOM     11  H   LIG    1       -4.889   2.251  -0.464  0.00  0.00    +0.170 HD
ATOM     12  C   LIG    1       -1.550  -1.147   0.404  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  15
ATOM     13  C   LIG    1        0.958  -0.560  -1.480  0.00  0.00    +0.138 C 
ATOM     14  N   LIG    1        1.197   0.022  -0.155  0.00  0.00    -0.270 N 
ATOM     15  C   LIG    1        0.157   0.681   0.524  0.00  0.00    +0.252 C 
ATOM     16  O   LIG    1        0.277   1.621   1.306  0.00  0.00    -0.270 OA
BRANCH  14  17
ATOM     17  C   LIG    1        2.560   0.037   0.335  0.00  0.00    +0.036 A 
ATOM     18  C   LIG    1        2.879   0.486   1.626  0.00  0.00    +0.023 A 
ATOM     19  C   LIG    1        4.196   0.476   2.104  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        5.229   0.004   1.304  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        4.941  -0.465   0.029  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        3.623  -0.453  -0.446  0.00  0.00    +0.023 A 
ENDBRANCH  14  17
ENDBRANCH   1  15
TORSDOF 2