REMARK  Name = BDB060374
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.658   0.168  -1.206  0.00  0.00    +0.014 C 
ATOM      2  C   LIG    1       -2.417  -0.120   0.293  0.00  0.00    +0.002 C 
ATOM      3  C   LIG    1       -1.535  -1.393   0.508  0.00  0.00    +0.167 C 
ATOM      4  C   LIG    1       -0.119  -1.078   0.188  0.00  0.00    +0.055 A 
ATOM      5  C   LIG    1        0.464   0.169   0.215  0.00  0.00    +0.029 A 
ATOM      6  C   LIG    1       -0.284   1.341   0.560  0.00  0.00    +0.072 A 
ATOM      7  N   LIG    1        0.183   2.546   0.596  0.00  0.00    -0.175 NA
ATOM      8  N   LIG    1        1.446   2.963   0.308  0.00  0.00    -0.242 N 
ATOM      9  H   LIG    1        1.552   3.969   0.413  0.00  0.00    +0.192 HD
ATOM     10  C   LIG    1        2.639   2.386  -0.077  0.00  0.00    +0.273 A 
ATOM     11  C   LIG    1        2.840   0.949  -0.320  0.00  0.00    +0.053 A 
ATOM     12  C   LIG    1        4.098   0.470  -0.726  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1        4.293  -0.883  -0.969  0.00  0.00    +0.126 A 
ATOM     14  C   LIG    1        3.267  -1.816  -0.827  0.00  0.00    +0.064 A 
ATOM     15  C   LIG    1        2.023  -1.328  -0.419  0.00  0.00    +0.051 A 
ATOM     16  F   LIG    1        5.503  -1.309  -1.357  0.00  0.00    -0.205 F 
ATOM     17  O   LIG    1        3.611   3.133  -0.231  0.00  0.00    -0.266 OA
ATOM     18  C   LIG    1        1.802   0.031  -0.163  0.00  0.00    +0.021 A 
ATOM     19  N   LIG    1        0.829  -1.982  -0.205  0.00  0.00    -0.355 N 
ATOM     20  H   LIG    1        0.656  -2.970  -0.352  0.00  0.00    +0.166 HD
ATOM     21  C   LIG    1       -1.747   1.119   0.965  0.00  0.00    +0.067 C 
ATOM     22  C   LIG    1       -3.795  -0.342   0.951  0.00  0.00    +0.014 C 
ENDROOT
BRANCH   3  23
ATOM     23  O   LIG    1       -1.902  -2.477  -0.328  0.00  0.00    -0.385 OA
ATOM     24  H   LIG    1       -2.835  -2.681  -0.147  0.00  0.00    +0.210 HD
ENDBRANCH   3  23
TORSDOF 1