REMARK  Name = BDB016494
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.237   2.890  -0.384  0.00  0.00    +0.172 C 
ATOM      2  N   LIG    1        3.658   1.571  -0.319  0.00  0.00    -0.272 N 
ATOM      3  N   LIG    1        2.880   1.246   0.714  0.00  0.00    -0.165 NA
ATOM      4  C   LIG    1        2.511  -0.037   0.496  0.00  0.00    +0.168 A 
ATOM      5  C   LIG    1        1.731  -0.767   1.511  0.00  0.00    +0.266 C 
ATOM      6  N   LIG    1        0.764  -0.122   2.265  0.00  0.00    -0.310 N 
ATOM      7  H   LIG    1        0.353  -0.762   2.932  0.00  0.00    +0.149 HD
ATOM      8  C   LIG    1        0.647   1.294   2.574  0.00  0.00    +0.104 C 
ATOM      9  C   LIG    1       -0.015   2.144   1.488  0.00  0.00    +0.019 C 
ATOM     10  C   LIG    1       -1.536   1.985   1.435  0.00  0.00    +0.002 C 
ATOM     11  C   LIG    1       -2.126   2.882   0.338  0.00  0.00    +0.002 C 
ATOM     12  C   LIG    1       -3.611   2.622   0.051  0.00  0.00    +0.023 C 
ATOM     13  C   LIG    1       -3.855   1.632  -1.094  0.00  0.00    +0.143 C 
ATOM     14  N   LIG    1       -3.469   0.273  -0.777  0.00  0.00    -0.271 N 
ATOM     15  N   LIG    1       -4.285  -0.490  -0.032  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1       -3.563  -1.592   0.182  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1       -2.288  -1.552  -0.439  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1       -1.178  -2.495  -0.383  0.00  0.00    -0.014 A 
ATOM     19  C   LIG    1        0.082  -2.193  -0.928  0.00  0.00    +0.021 A 
ATOM     20  C   LIG    1        1.139  -3.103  -0.801  0.00  0.00    +0.038 A 
ATOM     21  C   LIG    1        2.452  -2.880  -1.431  0.00  0.00    +0.248 C 
ATOM     22  N   LIG    1        3.098  -1.675  -1.484  0.00  0.00    -0.278 N 
ATOM     23  H   LIG    1        3.845  -1.722  -2.169  0.00  0.00    +0.155 HD
ATOM     24  O   LIG    1        2.955  -3.825  -2.046  0.00  0.00    -0.270 OA
ATOM     25  C   LIG    1        0.931  -4.340  -0.177  0.00  0.00    +0.013 A 
ATOM     26  C   LIG    1       -0.313  -4.653   0.358  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -1.357  -3.734   0.258  0.00  0.00    +0.008 A 
ATOM     28  C   LIG    1       -2.292  -0.341  -1.101  0.00  0.00    +0.116 A 
ATOM     29  O   LIG    1        1.906  -1.967   1.728  0.00  0.00    -0.268 OA
ATOM     30  C   LIG    1        3.079  -0.507  -0.741  0.00  0.00    +0.084 A 
ATOM     31  C   LIG    1        3.817   0.563  -1.209  0.00  0.00    +0.132 A 
ENDROOT
TORSDOF 0