REMARK  Name = BDB027889
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -4.011   2.085  -0.124  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -3.138   1.235   0.025  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1       -2.213   1.345   1.031  0.00  0.00    -0.255 N 
ATOM      4  H   LIG    1       -2.335   2.135   1.650  0.00  0.00    +0.158 HD
ATOM      5  C   LIG    1       -1.353   0.368   1.477  0.00  0.00    +0.239 C 
ATOM      6  O   LIG    1       -0.831   0.461   2.587  0.00  0.00    -0.273 OA
ATOM      7  C   LIG    1       -1.172  -0.845   0.554  0.00  0.00    +0.158 C 
ATOM      8  C   LIG    1       -1.682  -0.597  -0.864  0.00  0.00    +0.041 C 
ATOM      9  C   LIG    1       -3.088  -0.022  -0.810  0.00  0.00    +0.098 C 
ENDROOT
BRANCH   7  10
ATOM     10  N   LIG    1        0.196  -1.386   0.552  0.00  0.00    -0.333 N 
ATOM     11  H   LIG    1        0.349  -1.980   1.369  0.00  0.00    +0.147 HD
BRANCH  10  12
ATOM     12  C   LIG    1        1.358  -0.664   0.284  0.00  0.00    +0.028 A 
ATOM     13  C   LIG    1        1.401   0.641  -0.219  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1        2.619   1.264  -0.519  0.00  0.00    +0.040 A 
ATOM     15  C   LIG    1        3.809   0.575  -0.338  0.00  0.00    +0.124 A 
ATOM     16  F   LIG    1        4.972   1.172  -0.630  0.00  0.00    -0.205 F 
ATOM     17  C   LIG    1        3.804  -0.727   0.132  0.00  0.00    +0.040 A 
ATOM     18  C   LIG    1        2.584  -1.341   0.431  0.00  0.00    +0.026 A 
ENDBRANCH  10  12
ENDBRANCH   7  10
TORSDOF 2