REMARK  Name = BDB000636
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -3.685  -0.554  -0.443  0.00  0.00    -0.266 OA
ATOM      2  C   LIG    1       -2.497  -0.373  -0.300  0.00  0.00    +0.289 C 
ATOM      3  C   LIG    1       -1.402  -1.465  -0.171  0.00  0.00    +0.251 C 
ATOM      4  O   LIG    1       -1.583  -2.659  -0.194  0.00  0.00    -0.282 OA
ATOM      5  C   LIG    1       -0.135  -0.734  -0.017  0.00  0.00    +0.068 A 
ATOM      6  C   LIG    1       -0.460   0.625  -0.054  0.00  0.00    +0.046 A 
ATOM      7  C   LIG    1        0.500   1.606   0.063  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1        1.825   1.189   0.221  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1        2.158  -0.183   0.259  0.00  0.00    +0.060 A 
ATOM     10 CL   LIG    1        3.831  -0.577   0.459  0.00  0.00    -0.082 Cl
ATOM     11  C   LIG    1        1.167  -1.171   0.138  0.00  0.00    +0.072 A 
ATOM     12 CL   LIG    1        1.543  -2.851   0.181  0.00  0.00    -0.081 Cl
ATOM     13  N   LIG    1       -1.825   0.828  -0.218  0.00  0.00    -0.278 N 
ATOM     14  H   LIG    1       -2.299   1.718  -0.273  0.00  0.00    +0.155 HD
ENDROOT
TORSDOF 0