REMARK  Name = BDB018645
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.766   0.999  -0.472  0.00  0.00    -0.268 N 
ATOM      2  C   LIG    1       -1.273   0.931  -0.397  0.00  0.00    +0.132 C 
ATOM      3  C   LIG    1       -0.922  -0.527  -0.047  0.00  0.00    +0.069 C 
ATOM      4  C   LIG    1       -0.585  -0.616   1.443  0.00  0.00    +0.225 C 
ATOM      5  O   LIG    1       -1.401  -0.942   2.303  0.00  0.00    -0.275 OA
ATOM      6  N   LIG    1        0.676  -0.220   1.807  0.00  0.00    -0.285 N 
ATOM      7  H   LIG    1        0.848  -0.147   2.802  0.00  0.00    +0.155 HD
ATOM      8  C   LIG    1        1.726  -0.026   0.904  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        1.556  -0.389  -0.436  0.00  0.00    -0.025 A 
ATOM     10  C   LIG    1        2.616  -0.220  -1.332  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1        3.825   0.320  -0.889  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1        3.986   0.674   0.451  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1        2.938   0.494   1.353  0.00  0.00    +0.023 A 
ATOM     14  C   LIG    1        0.270  -1.045  -0.862  0.00  0.00    +0.054 C 
ATOM     15  C   LIG    1       -2.201  -1.296  -0.390  0.00  0.00    +0.037 C 
ATOM     16  C   LIG    1       -3.317  -0.315  -0.066  0.00  0.00    +0.117 C 
ENDROOT
BRANCH   1  18
ATOM     17  N   LIG    1       -4.052   3.137  -0.374  0.00  0.00    -0.174 NA
ATOM     18  C   LIG    1       -3.459   2.145  -0.419  0.00  0.00    +0.169 C 
ENDBRANCH   1  18
TORSDOF 1