REMARK  Name = BDB056179
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.748  -0.062   1.126  0.00  0.00    +0.065 C 
ATOM      2  C   LIG    1        1.558   0.064   0.169  0.00  0.00    +0.180 C 
ATOM      3  C   LIG    1        1.079   1.535   0.165  0.00  0.00    +0.261 C 
ATOM      4  O   LIG    1        1.827   2.505   0.270  0.00  0.00    -0.271 OA
ATOM      5  N   LIG    1       -0.258   1.709  -0.071  0.00  0.00    -0.279 N 
ATOM      6  H   LIG    1       -0.588   2.660  -0.167  0.00  0.00    +0.155 HD
ATOM      7  C   LIG    1       -1.149   0.637  -0.045  0.00  0.00    +0.076 A 
ATOM      8  C   LIG    1       -0.694  -0.642   0.279  0.00  0.00    +0.143 A 
ATOM      9  C   LIG    1       -1.597  -1.702   0.355  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -2.950  -1.485   0.089  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -3.401  -0.207  -0.241  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1       -2.502   0.860  -0.303  0.00  0.00    +0.027 A 
ATOM     13  O   LIG    1        0.610  -0.927   0.580  0.00  0.00    -0.475 OA
ATOM     14  C   LIG    1        2.016  -0.289  -1.254  0.00  0.00    +0.065 C 
ENDROOT
TORSDOF 0