REMARK  Name = BDB056181
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -3.455  -1.114  -0.290  0.00  0.00    -0.272 OA
ATOM      2  C   LIG    1       -2.371  -0.545  -0.186  0.00  0.00    +0.255 C 
ATOM      3  N   LIG    1       -1.205  -1.249  -0.092  0.00  0.00    -0.280 N 
ATOM      4  H   LIG    1       -1.275  -2.257  -0.101  0.00  0.00    +0.155 HD
ATOM      5  C   LIG    1        0.031  -0.611  -0.004  0.00  0.00    +0.076 A 
ATOM      6  C   LIG    1        0.112   0.781  -0.082  0.00  0.00    +0.142 A 
ATOM      7  C   LIG    1        1.357   1.406  -0.020  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1        2.516   0.643   0.130  0.00  0.00    +0.004 A 
ATOM      9  C   LIG    1        2.432  -0.747   0.211  0.00  0.00    +0.002 A 
ATOM     10  O   LIG    1       -0.968   1.600  -0.258  0.00  0.00    -0.481 OA
ATOM     11  C   LIG    1        1.188  -1.377   0.140  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1       -2.231   0.974  -0.092  0.00  0.00    +0.325 C 
ENDROOT
TORSDOF 0