REMARK  Name = BDB026708
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.270   1.387   0.853  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1       -0.376   0.025   0.555  0.00  0.00    -0.280 N 
ATOM      3  C   LIG    1        0.929  -0.476   0.533  0.00  0.00    +0.075 A 
ATOM      4  C   LIG    1        1.727   0.602   0.907  0.00  0.00    +0.090 A 
ATOM      5  C   LIG    1        3.117   0.455   1.023  0.00  0.00    +0.043 A 
ATOM      6  C   LIG    1        3.687  -0.779   0.693  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1        2.889  -1.851   0.289  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1        1.500  -1.715   0.183  0.00  0.00    +0.029 A 
ATOM      9  N   LIG    1        0.984   1.726   1.096  0.00  0.00    -0.232 NA
ENDROOT
BRANCH   2  10
ATOM     10  C   LIG    1       -1.583  -0.701   0.305  0.00  0.00    +0.140 A 
ATOM     11  N   LIG    1       -2.636  -0.027  -0.223  0.00  0.00    -0.232 NA
ATOM     12  C   LIG    1       -3.772  -0.716  -0.484  0.00  0.00    +0.065 A 
ATOM     13  C   LIG    1       -4.967   0.051  -0.977  0.00  0.00    +0.066 C 
ATOM     14  C   LIG    1       -5.854  -0.821  -1.849  0.00  0.00    +0.102 C 
ATOM     15  C   LIG    1       -6.140  -2.162  -1.208  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -5.114  -2.731  -0.498  0.00  0.00    -0.284 N 
ATOM     17  H   LIG    1       -5.268  -3.681  -0.183  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -7.196  -2.765  -1.383  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.914  -2.074  -0.215  0.00  0.00    +0.055 A 
ATOM     20  C   LIG    1       -2.853  -2.749   0.367  0.00  0.00    +0.029 A 
ATOM     21  C   LIG    1       -1.669  -2.055   0.630  0.00  0.00    +0.048 A 
ENDBRANCH   2  10
BRANCH   6  22
ATOM     22  C   LIG    1        5.148  -0.989   0.818  0.00  0.00    +0.246 C 
ATOM     23  N   LIG    1        6.021  -0.084   0.218  0.00  0.00    -0.304 N 
ATOM     24  C   LIG    1        7.440  -0.208   0.498  0.00  0.00    +0.132 C 
ATOM     25  C   LIG    1        5.657   0.843  -0.846  0.00  0.00    +0.132 C 
ATOM     26  O   LIG    1        5.521  -1.965   1.466  0.00  0.00    -0.270 OA
ENDBRANCH   6  22
BRANCH   1  28
ATOM     27  C   LIG    1       -1.170   3.365   2.100  0.00  0.00    +0.015 C 
ATOM     28  C   LIG    1       -1.424   2.352   0.976  0.00  0.00    +0.049 C 
ATOM     29  C   LIG    1       -1.644   3.090  -0.346  0.00  0.00    +0.015 C 
ENDBRANCH   1  28
TORSDOF 3