REMARK  Name = BDB051680
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        3.740   0.110  -0.586  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        2.598  -0.294  -0.410  0.00  0.00    +0.244 C 
ATOM      3  C   LIG    1        1.462   0.637  -0.152  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1        0.140   0.158  -0.109  0.00  0.00    -0.014 A 
ATOM      5  C   LIG    1       -0.916   1.052   0.154  0.00  0.00    -0.041 A 
ATOM      6  C   LIG    1       -0.635   2.406   0.377  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        0.679   2.875   0.323  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -2.331   0.542   0.271  0.00  0.00    +0.050 C 
ATOM      9  C   LIG    1       -2.498  -0.888  -0.263  0.00  0.00    +0.086 C 
ATOM     10  N   LIG    1       -1.407  -1.772   0.171  0.00  0.00    -0.308 NA
ATOM     11  H   LIG    1       -1.331  -1.723   1.188  0.00  0.00    +0.123 HD
ATOM     12  C   LIG    1       -0.140  -1.300  -0.418  0.00  0.00    +0.102 C 
ATOM     13  C   LIG    1        1.049  -2.156   0.059  0.00  0.00    +0.128 C 
ATOM     14  C   LIG    1        1.727   1.993   0.060  0.00  0.00    +0.013 A 
ATOM     15  N   LIG    1        2.308  -1.638  -0.435  0.00  0.00    -0.310 N 
ATOM     16  H   LIG    1        3.120  -2.241  -0.484  0.00  0.00    +0.149 HD
ENDROOT
TORSDOF 0