REMARK  Name = BDB019534
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.131   0.098   0.209  0.00  0.00    +0.052 A 
ATOM      2  C   LIG    1        2.940   0.390  -0.451  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1        1.890  -0.467  -1.040  0.00  0.00    +0.248 C 
ATOM      4  N   LIG    1        0.935   0.367  -1.592  0.00  0.00    -0.293 N 
ATOM      5  C   LIG    1        1.231   1.769  -1.405  0.00  0.00    +0.144 C 
ATOM      6  O   LIG    1        1.866  -1.682  -1.030  0.00  0.00    -0.270 OA
ATOM      7  C   LIG    1        2.536   1.719  -0.683  0.00  0.00    -0.015 A 
ATOM      8  C   LIG    1        3.305   2.792  -0.265  0.00  0.00    +0.044 A 
ATOM      9  C   LIG    1        4.495   2.513   0.391  0.00  0.00    +0.124 A 
ATOM     10  F   LIG    1        5.264   3.527   0.808  0.00  0.00    -0.205 F 
ATOM     11  C   LIG    1        4.909   1.198   0.627  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   1  15
ATOM     12  N   LIG    1        3.942  -2.363   0.332  0.00  0.00    -0.325 N 
ATOM     13  H   LIG    1        3.047  -2.374  -0.157  0.00  0.00    +0.145 HD
ATOM     14  H   LIG    1        4.382  -3.257   0.497  0.00  0.00    +0.145 HD
ATOM     15  C   LIG    1        4.689  -1.246   0.527  0.00  0.00    +0.242 C 
ATOM     16  O   LIG    1        5.825  -1.355   0.982  0.00  0.00    -0.270 OA
ENDBRANCH   1  15
BRANCH   4  17
ATOM     17  C   LIG    1       -0.280  -0.093  -2.243  0.00  0.00    +0.109 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -1.528   0.034  -1.367  0.00  0.00    +0.034 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.486  -0.902  -0.149  0.00  0.00    +0.086 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -2.666  -0.906   0.724  0.00  0.00    -0.298 NA
ATOM     21  C   LIG    1       -2.941   0.392   1.363  0.00  0.00    +0.112 C 
ATOM     22  C   LIG    1       -4.131   0.283   2.331  0.00  0.00    +0.175 C 
ATOM     23  O   LIG    1       -5.307  -0.185   1.655  0.00  0.00    -0.377 OA
ATOM     24  C   LIG    1       -5.055  -1.471   1.069  0.00  0.00    +0.175 C 
ATOM     25  C   LIG    1       -3.887  -1.407   0.070  0.00  0.00    +0.112 C 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 5