REMARK  Name = BDB046344
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.465   3.323  -0.148  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1       -0.927   2.222  -0.124  0.00  0.00    +0.257 A 
ATOM      3  C   LIG    1       -1.704   0.973   0.052  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1       -1.030  -0.265   0.070  0.00  0.00    -0.007 A 
ATOM      5  C   LIG    1       -1.796  -1.427   0.259  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1       -3.184  -1.350   0.415  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1       -3.817  -0.113   0.386  0.00  0.00    +0.124 A 
ATOM      8  F   LIG    1       -5.146  -0.051   0.538  0.00  0.00    -0.205 F 
ATOM      9  C   LIG    1        0.443  -0.292  -0.103  0.00  0.00    -0.006 A 
ATOM     10  C   LIG    1        1.183  -1.610  -0.127  0.00  0.00    +0.118 C 
ATOM     11  N   LIG    1        2.573  -1.526  -0.593  0.00  0.00    -0.312 NA
ATOM     12  H   LIG    1        3.056  -2.391  -0.356  0.00  0.00    +0.122 HD
ATOM     13  C   LIG    1        3.263  -0.392   0.019  0.00  0.00    +0.087 C 
ATOM     14  C   LIG    1        2.599   0.931  -0.381  0.00  0.00    +0.068 C 
ATOM     15  C   LIG    1        1.099   0.877  -0.242  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1       -3.092   1.053   0.207  0.00  0.00    +0.052 A 
ATOM     17  N   LIG    1        0.433   2.078  -0.250  0.00  0.00    -0.325 N 
ATOM     18  H   LIG    1        0.947   2.943  -0.370  0.00  0.00    +0.169 HD
ENDROOT
TORSDOF 0