REMARK  Name = BDB062462
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.739   0.601   1.337  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1       -1.029   0.786  -0.106  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1       -2.287   0.015  -0.575  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1       -3.464   0.380   0.252  0.00  0.00    -0.326 N 
ATOM      5  C   LIG    1       -3.202   0.208   1.695  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1       -1.938   0.995   2.113  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -4.686  -0.093  -0.263  0.00  0.00    +0.050 A 
ATOM      8  C   LIG    1       -5.549  -0.931   0.455  0.00  0.00    +0.054 A 
ATOM      9  C   LIG    1       -6.734  -1.320  -0.180  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1       -7.054  -0.891  -1.457  0.00  0.00    +0.108 A 
ATOM     11  C   LIG    1       -8.297  -1.488  -1.740  0.00  0.00    +0.162 A 
ATOM     12  N   LIG    1       -8.746  -2.243  -0.729  0.00  0.00    -0.180 NA
ATOM     13  N   LIG    1       -6.264  -0.069  -2.184  0.00  0.00    -0.250 NA
ATOM     14  N   LIG    1       -7.777  -2.120   0.200  0.00  0.00    -0.275 N 
ATOM     15  H   LIG    1       -7.891  -2.613   1.078  0.00  0.00    +0.189 HD
ATOM     16  C   LIG    1       -5.121   0.295  -1.545  0.00  0.00    +0.134 A 
ENDBRANCH   4   7
BRANCH   1  17
ATOM     17  C   LIG    1        0.422   1.398   1.763  0.00  0.00    +0.121 C 
BRANCH  17  27
ATOM     18  C   LIG    1        6.185   0.038  -0.973  0.00  0.00    +0.019 A 
ATOM     19  C   LIG    1        5.818   1.458  -1.310  0.00  0.00    +0.252 A 
ATOM     20  O   LIG    1        6.548   2.170  -1.993  0.00  0.00    -0.268 OA
ATOM     21  N   LIG    1        4.628   1.935  -0.824  0.00  0.00    -0.321 N 
ATOM     22  H   LIG    1        4.405   2.891  -1.063  0.00  0.00    +0.169 HD
ATOM     23  C   LIG    1        3.759   1.169  -0.041  0.00  0.00    +0.068 A 
ATOM     24  C   LIG    1        4.090  -0.145   0.277  0.00  0.00    +0.088 A 
ATOM     25  N   LIG    1        3.312  -0.954   1.025  0.00  0.00    -0.253 NA
ATOM     26  C   LIG    1        2.149  -0.420   1.471  0.00  0.00    +0.116 A 
ATOM     27  C   LIG    1        1.726   0.884   1.208  0.00  0.00    -0.013 A 
ATOM     28  C   LIG    1        2.562   1.695   0.432  0.00  0.00    +0.034 A 
ATOM     29  C   LIG    1        5.346  -0.697  -0.219  0.00  0.00    +0.038 A 
BRANCH  18  31
ATOM     30  C   LIG    1        7.918  -1.859  -1.222  0.00  0.00    +0.009 C 
ATOM     31  C   LIG    1        7.506  -0.426  -1.539  0.00  0.00    +0.037 C 
ENDBRANCH  18  31
ENDBRANCH  17  27
ENDBRANCH   1  17
TORSDOF 4