REMARK  Name = BDB027964
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.921  -0.599   0.467  0.00  0.00    +0.029 A 
ATOM      2  C   LIG    1        0.344  -0.053   0.163  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        1.525  -0.817   0.080  0.00  0.00    +0.032 A 
ATOM      4  C   LIG    1        1.398  -2.183   0.358  0.00  0.00    +0.023 A 
ATOM      5  C   LIG    1        0.168  -2.749   0.698  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1       -0.979  -1.959   0.764  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   3   7
ATOM      7  N   LIG    1        2.745  -0.236  -0.236  0.00  0.00    -0.327 N 
ATOM      8  C   LIG    1        4.019  -0.941  -0.017  0.00  0.00    +0.120 C 
ATOM      9  C   LIG    1        5.189   0.067   0.054  0.00  0.00    +0.100 C 
ATOM     10  N   LIG    1        5.361   0.930  -1.131  0.00  0.00    -0.313 NA
ATOM     11  H   LIG    1        5.650   1.853  -0.810  0.00  0.00    +0.122 HD
ATOM     12  C   LIG    1        4.105   1.046  -1.891  0.00  0.00    +0.100 C 
ATOM     13  C   LIG    1        2.807   0.988  -1.052  0.00  0.00    +0.120 C 
ENDBRANCH   3   7
BRANCH   1  14
ATOM     14  N   LIG    1       -2.006   0.280   0.578  0.00  0.00    -0.333 N 
ATOM     15  H   LIG    1       -1.887   1.066  -0.056  0.00  0.00    +0.147 HD
BRANCH  14  22
ATOM     16  O   LIG    1       -5.501   1.939  -2.157  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1       -4.797   1.361  -1.334  0.00  0.00    +0.219 C 
ATOM     18  N   LIG    1       -4.273   0.124  -1.602  0.00  0.00    -0.255 N 
ATOM     19  H   LIG    1       -4.604  -0.287  -2.465  0.00  0.00    +0.158 HD
ATOM     20  C   LIG    1       -3.881  -0.793  -0.655  0.00  0.00    +0.239 C 
ATOM     21  O   LIG    1       -3.949  -1.998  -0.887  0.00  0.00    -0.273 OA
ATOM     22  C   LIG    1       -3.387  -0.217   0.677  0.00  0.00    +0.158 C 
ATOM     23  C   LIG    1       -4.318   0.925   1.090  0.00  0.00    +0.041 C 
ATOM     24  C   LIG    1       -4.445   1.977  -0.002  0.00  0.00    +0.098 C 
ENDBRANCH  14  22
ENDBRANCH   1  14
TORSDOF 3