REMARK  Name = BDB047640
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.951  -1.157   0.357  0.00  0.00    +0.028 C 
ATOM      2  C   LIG    1        1.678  -0.305   0.378  0.00  0.00    +0.076 C 
ATOM      3  N   LIG    1        0.626  -1.047  -0.305  0.00  0.00    -0.339 N 
ATOM      4  H   LIG    1        0.685  -2.050  -0.139  0.00  0.00    +0.146 HD
ATOM      5  C   LIG    1       -0.700  -0.602  -0.206  0.00  0.00    +0.049 A 
ATOM      6  C   LIG    1       -1.134   0.711   0.069  0.00  0.00    +0.054 A 
ATOM      7  C   LIG    1       -2.518   0.979   0.135  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1       -3.470  -0.006  -0.126  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -3.052  -1.281  -0.467  0.00  0.00    +0.002 A 
ATOM     10  N   LIG    1       -0.326   1.841   0.305  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1       -0.801   2.691   0.583  0.00  0.00    +0.155 HD
ATOM     12  C   LIG    1        1.007   2.059   0.172  0.00  0.00    +0.219 C 
ATOM     13  O   LIG    1        1.446   3.179   0.450  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -1.687  -1.566  -0.515  0.00  0.00    +0.025 A 
ATOM     15  C   LIG    1        1.916   0.997  -0.356  0.00  0.00    +0.118 C 
ENDROOT
TORSDOF 0