REMARK  Name = BDB026343
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.559  -0.503  -1.591  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1       -1.117   0.011  -0.313  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1       -1.951   1.312  -0.427  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1       -3.026   1.165  -1.438  0.00  0.00    -0.326 N 
ATOM      5  C   LIG    1       -2.519   0.681  -2.739  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1       -1.661  -0.599  -2.580  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -4.274   0.759  -0.965  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1       -4.902   1.416   0.103  0.00  0.00    +0.134 A 
ATOM      9  N   LIG    1       -6.112   1.109   0.639  0.00  0.00    -0.249 NA
ATOM     10  C   LIG    1       -6.784   0.083   0.072  0.00  0.00    +0.125 A 
ATOM     11  C   LIG    1       -6.275  -0.629  -1.007  0.00  0.00    +0.035 A 
ATOM     12  C   LIG    1       -5.022  -0.281  -1.523  0.00  0.00    +0.027 A 
BRANCH  10  13
ATOM     13  C   LIG    1       -8.129  -0.309   0.619  0.00  0.00    +0.262 C 
ATOM     14  N   LIG    1       -8.724   0.361   1.664  0.00  0.00    -0.313 N 
ATOM     15  H   LIG    1       -9.627  -0.019   1.917  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1       -8.240   1.506   2.396  0.00  0.00    +0.128 C 
ATOM     17  O   LIG    1       -8.735  -1.262   0.125  0.00  0.00    -0.269 OA
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  18
ATOM     18  C   LIG    1        0.542   0.328  -2.105  0.00  0.00    +0.119 C 
BRANCH  18  28
ATOM     19  C   LIG    1        5.811  -1.024   1.418  0.00  0.00    +0.106 A 
ATOM     20  C   LIG    1        5.222  -2.354   0.945  0.00  0.00    +0.271 A 
ATOM     21  O   LIG    1        5.744  -3.417   1.247  0.00  0.00    -0.266 OA
ATOM     22  N   LIG    1        4.090  -2.263   0.176  0.00  0.00    -0.319 N 
ATOM     23  H   LIG    1        3.677  -3.126  -0.147  0.00  0.00    +0.169 HD
ATOM     24  C   LIG    1        3.523  -1.027  -0.145  0.00  0.00    +0.068 A 
ATOM     25  C   LIG    1        4.128   0.146   0.329  0.00  0.00    +0.088 A 
ATOM     26  C   LIG    1        3.554   1.375   0.003  0.00  0.00    +0.030 A 
ATOM     27  C   LIG    1        2.396   1.436  -0.779  0.00  0.00    +0.007 A 
ATOM     28  C   LIG    1        1.789   0.261  -1.247  0.00  0.00    -0.031 A 
ATOM     29  C   LIG    1        2.369  -0.977  -0.928  0.00  0.00    +0.032 A 
ATOM     30  N   LIG    1        5.292   0.132   1.117  0.00  0.00    -0.245 NA
BRANCH  19  31
ATOM     31  C   LIG    1        7.071  -1.087   2.248  0.00  0.00    +0.061 C 
BRANCH  31  33
ATOM     32  C   LIG    1        9.579  -1.260   2.159  0.00  0.00    +0.004 C 
ATOM     33  C   LIG    1        8.295  -1.217   1.348  0.00  0.00    +0.003 C 
ENDBRANCH  31  33
ENDBRANCH  19  31
ENDBRANCH  18  28
ENDBRANCH   1  18
TORSDOF 6