REMARK  Name = BDB014369
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.969   0.526   0.387  0.00  0.00    +0.064 A 
ATOM      2  C   LIG    1       -3.607   0.219   0.556  0.00  0.00    +0.103 A 
ATOM      3  C   LIG    1       -3.220  -0.464   1.708  0.00  0.00    +0.068 A 
ATOM      4  N   LIG    1       -1.862  -0.602   1.578  0.00  0.00    -0.326 N 
ATOM      5  H   LIG    1       -1.237  -1.003   2.257  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -1.475  -0.058   0.381  0.00  0.00    +0.197 A 
ATOM      7  C   LIG    1       -4.109  -0.859   2.711  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1       -5.459  -0.547   2.521  0.00  0.00    +0.003 A 
ATOM      9  N   LIG    1       -2.511   0.447  -0.246  0.00  0.00    -0.214 NA
ATOM     10  C   LIG    1       -5.888   0.134   1.379  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  11
ATOM     11  N   LIG    1       -0.178  -0.036  -0.006  0.00  0.00    -0.298 N 
ATOM     12  C   LIG    1        0.777  -1.088   0.388  0.00  0.00    +0.127 C 
ATOM     13  C   LIG    1        1.728  -1.466  -0.768  0.00  0.00    +0.127 C 
ATOM     14  N   LIG    1        2.437  -0.290  -1.286  0.00  0.00    -0.297 N 
ATOM     15  C   LIG    1        1.655   0.959  -1.366  0.00  0.00    +0.127 C 
ATOM     16  C   LIG    1        0.137   0.700  -1.250  0.00  0.00    +0.127 C 
BRANCH  14  17
ATOM     17  C   LIG    1        3.761  -0.112  -0.910  0.00  0.00    +0.218 A 
ATOM     18  N   LIG    1        4.416  -1.117  -0.307  0.00  0.00    -0.221 NA
ATOM     19  C   LIG    1        5.717  -0.920   0.006  0.00  0.00    +0.138 A 
ATOM     20  C   LIG    1        6.433   0.219  -0.290  0.00  0.00    +0.061 A 
ATOM     21  C   LIG    1        5.652   1.208  -0.844  0.00  0.00    +0.138 A 
ATOM     22  N   LIG    1        4.352   1.064  -1.181  0.00  0.00    -0.221 NA
BRANCH  20  23
ATOM     23  N   LIG    1        7.738   0.435   0.153  0.00  0.00    -0.356 N 
ATOM     24  H   LIG    1        8.239   1.156  -0.360  0.00  0.00    +0.142 HD
ATOM     25  H   LIG    1        8.291  -0.411   0.258  0.00  0.00    +0.142 HD
ENDBRANCH  20  23
ENDBRANCH  14  17
ENDBRANCH   6  11
BRANCH   1  29
ATOM     26  N   LIG    1       -6.555   0.764  -1.413  0.00  0.00    -0.325 N 
ATOM     27  H   LIG    1       -6.854  -0.188  -1.251  0.00  0.00    +0.145 HD
ATOM     28  H   LIG    1       -6.779   1.179  -2.309  0.00  0.00    +0.145 HD
ATOM     29  C   LIG    1       -5.432   1.262  -0.805  0.00  0.00    +0.244 C 
ATOM     30  O   LIG    1       -4.877   2.262  -1.234  0.00  0.00    -0.270 OA
ENDBRANCH   1  29
TORSDOF 4