REMARK  Name = BDB015839
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.748   1.527   0.457  0.00  0.00    +0.071 A 
ATOM      2  N   LIG    1        0.912   2.509   0.036  0.00  0.00    -0.254 NA
ATOM      3  C   LIG    1       -0.393   2.194  -0.162  0.00  0.00    +0.120 A 
ATOM      4  C   LIG    1       -0.942   0.934   0.045  0.00  0.00    +0.003 A 
ATOM      5  C   LIG    1       -0.070  -0.061   0.486  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1        1.280   0.235   0.695  0.00  0.00    +0.029 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        5.564   1.411   0.598  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        4.224   1.034   0.401  0.00  0.00    +0.018 A 
ATOM      9  C   LIG    1        3.158   1.921   0.651  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        3.483   3.215   1.095  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1        4.809   3.603   1.299  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        5.844   2.702   1.056  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        8.339  -2.196  -1.391  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        7.861  -1.117  -0.561  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        8.649  -0.635   0.416  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        7.914   0.340   0.957  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        6.649   0.480   0.338  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        6.653  -0.486  -0.647  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -2.350   0.680  -0.196  0.00  0.00    +0.021 A 
ATOM     20  C   LIG    1       -3.098  -0.314   0.403  0.00  0.00    +0.117 A 
ATOM     21  N   LIG    1       -4.370  -0.196  -0.089  0.00  0.00    -0.268 N 
ATOM     22  N   LIG    1       -4.502   0.813  -0.970  0.00  0.00    -0.179 NA
ATOM     23  C   LIG    1       -3.279   1.342  -1.033  0.00  0.00    +0.143 A 
BRANCH  21  24
ATOM     24  C   LIG    1       -5.514  -1.035   0.257  0.00  0.00    +0.110 C 
ATOM     25  C   LIG    1       -5.814  -2.041  -0.863  0.00  0.00    +0.042 C 
ATOM     26  C   LIG    1       -7.251  -2.536  -0.762  0.00  0.00    +0.083 C 
ATOM     27  N   LIG    1       -8.231  -1.462  -0.905  0.00  0.00    -0.316 NA
ATOM     28  H   LIG    1       -9.091  -1.709  -0.416  0.00  0.00    +0.122 HD
ATOM     29  C   LIG    1       -7.758  -0.143  -0.480  0.00  0.00    +0.083 C 
ATOM     30  C   LIG    1       -6.751  -0.216   0.661  0.00  0.00    +0.042 C 
ENDBRANCH  21  24
ENDBRANCH   4  19
TORSDOF 4