REMARK  Name = BDB047637
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.877   0.096  -1.283  0.00  0.00    +0.031 C 
ATOM      2  C   LIG    1       -1.585   0.108   0.226  0.00  0.00    +0.035 C 
ATOM      3  N   LIG    1       -0.436   0.956   0.530  0.00  0.00    -0.337 N 
ATOM      4  H   LIG    1       -0.643   1.946   0.413  0.00  0.00    +0.147 HD
ATOM      5  C   LIG    1        0.881   0.666   0.178  0.00  0.00    +0.049 A 
ATOM      6  C   LIG    1        1.415  -0.578  -0.206  0.00  0.00    +0.054 A 
ATOM      7  C   LIG    1        2.784  -0.672  -0.538  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1        3.642   0.421  -0.437  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1        3.144   1.633   0.004  0.00  0.00    +0.002 A 
ATOM     10  N   LIG    1        0.720  -1.794  -0.333  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1        1.220  -2.565  -0.756  0.00  0.00    +0.155 HD
ATOM     12  C   LIG    1       -0.523  -2.176   0.045  0.00  0.00    +0.219 C 
ATOM     13  O   LIG    1       -0.891  -3.322  -0.230  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1        1.788   1.745   0.313  0.00  0.00    +0.025 A 
ATOM     15  C   LIG    1       -1.402  -1.269   0.843  0.00  0.00    +0.121 C 
ATOM     16  C   LIG    1       -2.798   0.767   0.927  0.00  0.00    +0.031 C 
ENDROOT
TORSDOF 0