REMARK  Name = BDB027933
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.159  -1.029  -0.336  0.00  0.00    -0.330 N 
ATOM      2  H   LIG    1        0.030  -1.277  -1.328  0.00  0.00    +0.147 HD
ENDROOT
BRANCH   1   9
ATOM      3  O   LIG    1       -4.832   1.181   0.073  0.00  0.00    -0.275 OA
ATOM      4  C   LIG    1       -3.651   0.848   0.098  0.00  0.00    +0.219 C 
ATOM      5  N   LIG    1       -2.834   1.063  -0.984  0.00  0.00    -0.255 N 
ATOM      6  H   LIG    1       -3.302   1.408  -1.811  0.00  0.00    +0.158 HD
ATOM      7  C   LIG    1       -1.602   0.492  -1.199  0.00  0.00    +0.239 C 
ATOM      8  O   LIG    1       -1.129   0.432  -2.332  0.00  0.00    -0.273 OA
ATOM      9  C   LIG    1       -0.883  -0.053   0.049  0.00  0.00    +0.158 C 
ATOM     10  C   LIG    1       -1.923  -0.762   0.915  0.00  0.00    +0.041 C 
ATOM     11  C   LIG    1       -3.010   0.224   1.314  0.00  0.00    +0.098 C 
ENDBRANCH   1   9
BRANCH   1  12
ATOM     12  C   LIG    1        1.502  -0.581  -0.192  0.00  0.00    +0.082 A 
ATOM     13  C   LIG    1        2.097  -0.196   1.025  0.00  0.00    +0.065 A 
ATOM     14 CL   LIG    1        1.260  -0.271   2.538  0.00  0.00    -0.082 Cl
ATOM     15  C   LIG    1        3.435   0.227   1.069  0.00  0.00    +0.022 A 
ATOM     16  C   LIG    1        4.211   0.258  -0.089  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        3.654  -0.148  -1.296  0.00  0.00    +0.040 A 
ATOM     18  C   LIG    1        2.326  -0.567  -1.334  0.00  0.00    +0.146 A 
ATOM     19  F   LIG    1        1.815  -0.963  -2.511  0.00  0.00    -0.204 F 
ENDBRANCH   1  12
TORSDOF 2