REMARK  Name = BDB015946
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.697   2.054  -0.142  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.105   0.985   0.032  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.440   1.166  -0.024  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1       -1.996   2.423  -0.274  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -1.084   3.450  -0.435  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.253   3.301  -0.368  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.081   0.325   0.232  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.696   0.554   0.165  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.157   1.836  -0.073  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        3.068   2.894  -0.242  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.447   2.685  -0.177  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.950   1.407   0.059  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        6.936  -3.740   0.266  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.862  -2.803   0.486  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        4.784  -3.187   1.192  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        4.007  -2.101   1.187  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.584  -1.014   0.488  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.792  -1.513   0.044  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.421   2.670  -0.387  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -4.078   3.777   0.113  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -5.397   3.612  -0.201  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.484   4.508   0.111  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.650   2.473  -0.868  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.447   1.905  -0.989  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.280   0.044   0.151  0.00  0.00    -0.326 N 
ATOM     26  H   LIG    1       -2.978   0.282   0.854  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.619  -1.228   0.446  0.00  0.00    +0.073 C 
ATOM     28  C   LIG    1       -2.669  -2.260   0.888  0.00  0.00    +0.040 C 
ATOM     29  C   LIG    1       -2.109  -3.581   0.377  0.00  0.00    +0.052 C 
ATOM     30  C   LIG    1       -1.615  -3.204  -1.013  0.00  0.00    +0.020 C 
ATOM     31  C   LIG    1       -0.956  -1.843  -0.803  0.00  0.00    +0.024 C 
BRANCH  29  32
ATOM     32  N   LIG    1       -3.087  -4.657   0.356  0.00  0.00    -0.327 NA
ATOM     33  H   LIG    1       -3.872  -4.406  -0.245  0.00  0.00    +0.118 HD
ATOM     34  H   LIG    1       -3.478  -4.789   1.288  0.00  0.00    +0.118 HD
ENDBRANCH  29  32
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 6