REMARK  Name = BDB014707
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.677   0.845  -1.252  0.00  0.00    +0.121 C 
ATOM      2  N   LIG    1        0.160   1.845  -1.278  0.00  0.00    -0.285 NA
ATOM      3  H   LIG    1        1.010   1.510  -1.748  0.00  0.00    +0.188 HD
ENDROOT
BRANCH   1  12
ATOM      4  C   LIG    1       -2.739   2.202  -0.925  0.00  0.00    +0.013 C 
ATOM      5  C   LIG    1       -4.130   2.363  -0.343  0.00  0.00    +0.070 C 
ATOM      6  C   LIG    1       -4.753   1.039   0.090  0.00  0.00    +0.114 C 
ATOM      7  N   LIG    1       -3.814   0.230   0.857  0.00  0.00    -0.297 N 
ATOM      8  C   LIG    1       -4.312  -0.539   1.902  0.00  0.00    +0.213 C 
ATOM      9  O   LIG    1       -5.484  -0.482   2.275  0.00  0.00    -0.276 OA
ATOM     10  C   LIG    1       -3.343  -1.464   2.595  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1       -2.535  -0.056   0.209  0.00  0.00    +0.147 C 
ATOM     12  C   LIG    1       -2.051   1.065  -0.669  0.00  0.00    +0.026 C 
BRANCH   4  14
ATOM     13  C   LIG    1       -2.649   4.631  -1.597  0.00  0.00    +0.125 C 
ATOM     14  N   LIG    1       -2.246   3.244  -1.711  0.00  0.00    -0.350 N 
ATOM     15  H   LIG    1       -1.222   3.145  -1.806  0.00  0.00    +0.145 HD
ENDBRANCH   4  14
ENDBRANCH   1  12
BRANCH   1  16
ATOM     16  N   LIG    1       -0.325  -0.382  -1.767  0.00  0.00    -0.300 N 
ATOM     17  H   LIG    1       -1.089  -0.977  -2.067  0.00  0.00    +0.154 HD
BRANCH  16  18
ATOM     18  C   LIG    1        0.819  -1.135  -1.414  0.00  0.00    +0.033 A 
ATOM     19  C   LIG    1        1.718  -0.739  -0.414  0.00  0.00    +0.032 A 
ATOM     20  C   LIG    1        2.872  -1.486  -0.128  0.00  0.00    -0.013 A 
ATOM     21  C   LIG    1        3.124  -2.648  -0.867  0.00  0.00    +0.012 A 
ATOM     22  C   LIG    1        2.245  -3.065  -1.874  0.00  0.00    -0.048 A 
ATOM     23  C   LIG    1        2.555  -4.282  -2.695  0.00  0.00    +0.044 C 
ATOM     24  C   LIG    1        1.110  -2.292  -2.151  0.00  0.00    +0.026 A 
BRANCH  20  25
ATOM     25  C   LIG    1        3.793  -1.072   0.919  0.00  0.00    +0.020 A 
ATOM     26  C   LIG    1        3.989   0.227   1.343  0.00  0.00    +0.116 A 
ATOM     27  N   LIG    1        4.938   0.175   2.323  0.00  0.00    -0.274 N 
ATOM     28  C   LIG    1        5.477   1.285   3.070  0.00  0.00    +0.172 C 
ATOM     29  N   LIG    1        5.383  -1.069   2.571  0.00  0.00    -0.179 NA
ATOM     30  C   LIG    1        4.688  -1.824   1.716  0.00  0.00    +0.142 A 
ENDBRANCH  20  25
ENDBRANCH  16  18
ENDBRANCH   1  16
TORSDOF 5