REMARK  Name = BDB026392
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.255   2.263   0.299  0.00  0.00    +0.154 C 
ATOM      2  N   LIG    1        1.429   1.112   0.058  0.00  0.00    -0.293 N 
ATOM      3  C   LIG    1        1.844  -0.232  -0.006  0.00  0.00    +0.100 A 
ATOM      4  C   LIG    1        0.701  -1.006  -0.249  0.00  0.00    +0.073 A 
ATOM      5  C   LIG    1        0.753  -2.387  -0.368  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1        1.998  -3.013  -0.251  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        3.158  -2.259  -0.012  0.00  0.00    +0.035 A 
ATOM      8  N   LIG    1       -0.406  -0.143  -0.338  0.00  0.00    -0.280 N 
ATOM      9  C   LIG    1        3.067  -0.864   0.114  0.00  0.00    +0.152 A 
ATOM     10  C   LIG    1        0.034   1.177  -0.124  0.00  0.00    +0.331 A 
ATOM     11  O   LIG    1       -0.664   2.177  -0.102  0.00  0.00    -0.246 OA
ENDROOT
BRANCH   8  12
ATOM     12  C   LIG    1       -1.792  -0.550  -0.477  0.00  0.00    +0.179 C 
ATOM     13  C   LIG    1       -2.474   0.250  -1.591  0.00  0.00    +0.242 C 
ATOM     14  O   LIG    1       -2.130   0.165  -2.769  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -3.469   1.118  -1.214  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -3.887   1.657  -1.959  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -3.833   1.494   0.054  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -4.687   2.359   0.233  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.121   0.822   1.203  0.00  0.00    +0.099 C 
ATOM     20  C   LIG    1       -2.593  -0.550   0.823  0.00  0.00    +0.044 C 
ENDBRANCH   8  12
BRANCH   9  21
ATOM     21  N   LIG    1        4.277  -0.135   0.378  0.00  0.00    +0.059 N 
ATOM     22  O   LIG    1        4.438   0.293   1.528  0.00  0.00    -0.126 OA
ATOM     23  O   LIG    1        5.076  -0.015  -0.559  0.00  0.00    -0.126 OA
ENDBRANCH   9  21
TORSDOF 2