REMARK  Name = BDB018698
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.692   1.014   0.372  0.00  0.00    -0.267 N 
ATOM      2  C   LIG    1       -1.195   0.967   0.343  0.00  0.00    +0.151 C 
ATOM      3  C   LIG    1       -0.805  -0.381  -0.311  0.00  0.00    +0.128 C 
ATOM      4  C   LIG    1       -0.326  -1.367   0.791  0.00  0.00    +0.242 C 
ATOM      5  O   LIG    1       -1.078  -2.110   1.420  0.00  0.00    -0.273 OA
ATOM      6  N   LIG    1        1.011  -1.302   1.119  0.00  0.00    -0.281 N 
ATOM      7  H   LIG    1        1.323  -1.860   1.902  0.00  0.00    +0.155 HD
ATOM      8  C   LIG    1        1.925  -0.571   0.346  0.00  0.00    +0.074 A 
ATOM      9  C   LIG    1        1.511   0.018  -0.860  0.00  0.00    +0.141 A 
ATOM     10  N   LIG    1        2.330   0.765  -1.619  0.00  0.00    -0.239 NA
ATOM     11  C   LIG    1        3.604   0.910  -1.188  0.00  0.00    +0.113 A 
ATOM     12  C   LIG    1        4.102   0.341  -0.024  0.00  0.00    +0.022 A 
ATOM     13  C   LIG    1        3.241  -0.420   0.761  0.00  0.00    +0.028 A 
ATOM     14  N   LIG    1        0.225  -0.208  -1.352  0.00  0.00    -0.313 N 
ATOM     15  H   LIG    1        0.039   0.450  -2.104  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1       -2.104  -0.856  -0.961  0.00  0.00    +0.056 C 
ATOM     17  C   LIG    1       -3.194  -0.316  -0.051  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1  19
ATOM     18  N   LIG    1       -3.981   2.588   1.819  0.00  0.00    -0.174 NA
ATOM     19  C   LIG    1       -3.388   1.859   1.145  0.00  0.00    +0.169 C 
ENDBRANCH   1  19
TORSDOF 1