REMARK  Name = BDB003119
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.322  -1.598   1.815  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        0.095  -1.144   0.703  0.00  0.00    +0.249 C 
ATOM      3  N   LIG    1        0.912  -0.376  -0.098  0.00  0.00    -0.281 N 
ATOM      4  H   LIG    1        0.526  -0.070  -0.989  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        2.217   0.070   0.193  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1        2.833   0.902  -0.754  0.00  0.00    +0.026 A 
ATOM      7  C   LIG    1        4.124   1.389  -0.539  0.00  0.00    +0.040 A 
ATOM      8  C   LIG    1        4.801   1.041   0.622  0.00  0.00    +0.124 A 
ATOM      9  F   LIG    1        6.040   1.505   0.829  0.00  0.00    -0.205 F 
ATOM     10  C   LIG    1        4.208   0.218   1.570  0.00  0.00    +0.040 A 
ATOM     11  C   LIG    1        2.915  -0.268   1.356  0.00  0.00    +0.026 A 
ENDBRANCH   3   5
BRANCH   2  12
ATOM     12  C   LIG    1       -1.223  -1.423   0.096  0.00  0.00    +0.040 A 
ATOM     13  C   LIG    1       -2.286  -0.502   0.160  0.00  0.00    -0.033 A 
ATOM     14  C   LIG    1       -3.508  -0.867  -0.432  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1       -3.656  -2.101  -1.072  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -2.593  -2.999  -1.124  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1       -1.376  -2.664  -0.535  0.00  0.00    +0.013 A 
BRANCH  13  18
ATOM     18  C   LIG    1       -2.175   0.839   0.858  0.00  0.00    +0.064 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.295   2.042  -0.073  0.00  0.00    +0.215 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -0.989   2.264  -0.771  0.00  0.00    +0.023 N 
ATOM     21  O   LIG    1       -0.288   3.200  -0.372  0.00  0.00    -0.132 OA
ATOM     22  O   LIG    1       -0.697   1.494  -1.698  0.00  0.00    -0.132 OA
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  13  18
ENDBRANCH   2  12
TORSDOF 5