REMARK  Name = BDB032413
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.088   0.266  -0.751  0.00  0.00    -0.340 N 
ATOM      2  H   LIG    1        1.399  -0.277  -0.236  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        3.378   0.119  -0.238  0.00  0.00    +0.028 A 
ATOM      4  C   LIG    1        3.711  -1.083   0.404  0.00  0.00    +0.031 A 
ATOM      5  C   LIG    1        5.006  -1.341   0.894  0.00  0.00    -0.011 A 
ATOM      6  C   LIG    1        6.025  -0.384   0.719  0.00  0.00    +0.022 A 
ATOM      7  C   LIG    1        7.308  -0.694   1.235  0.00  0.00    +0.124 A 
ATOM      8  N   LIG    1        7.585  -1.846   1.872  0.00  0.00    -0.240 NA
ATOM      9  C   LIG    1        6.587  -2.739   2.016  0.00  0.00    +0.113 A 
ATOM     10  C   LIG    1        5.698   0.807   0.034  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1        5.301  -2.537   1.552  0.00  0.00    +0.028 A 
ATOM     12  C   LIG    1        4.403   1.042  -0.446  0.00  0.00    +0.023 A 
BRANCH   7  13
ATOM     13  N   LIG    1        8.383   0.200   1.100  0.00  0.00    -0.343 N 
ATOM     14  H   LIG    1        8.554   0.365   0.114  0.00  0.00    +0.144 HD
ATOM     15  H   LIG    1        8.141   1.081   1.542  0.00  0.00    +0.144 HD
ENDBRANCH   7  13
ENDBRANCH   1   3
BRANCH   1  16
ATOM     16  C   LIG    1        1.582   1.587  -1.105  0.00  0.00    +0.140 C 
BRANCH  16  20
ATOM     17  N   LIG    1       -2.064   1.772  -1.375  0.00  0.00    -0.271 N 
ATOM     18  N   LIG    1       -1.802   1.440  -2.651  0.00  0.00    -0.179 NA
ATOM     19  C   LIG    1       -0.473   1.328  -2.683  0.00  0.00    +0.139 A 
ATOM     20  C   LIG    1        0.128   1.609  -1.435  0.00  0.00    +0.007 A 
ATOM     21  C   LIG    1       -0.941   1.892  -0.607  0.00  0.00    +0.113 A 
BRANCH  17  22
ATOM     22  C   LIG    1       -3.435   1.983  -0.945  0.00  0.00    +0.147 C 
BRANCH  22  27
ATOM     23  C   LIG    1       -5.017  -2.354   1.063  0.00  0.00    +0.104 C 
ATOM     24  N   LIG    1       -5.883  -1.387   0.392  0.00  0.00    -0.305 NA
ATOM     25  C   LIG    1       -5.966  -0.117   1.126  0.00  0.00    +0.084 C 
ATOM     26  C   LIG    1       -5.390   1.098   0.387  0.00  0.00    +0.020 C 
ATOM     27  C   LIG    1       -4.048   0.750  -0.266  0.00  0.00    +0.013 C 
ATOM     28  C   LIG    1       -4.222  -0.433  -1.240  0.00  0.00    +0.020 C 
ATOM     29  C   LIG    1       -5.524  -1.211  -1.016  0.00  0.00    +0.084 C 
ENDBRANCH  22  27
ENDBRANCH  17  22
ENDBRANCH  16  20
ENDBRANCH   1  16
TORSDOF 6