REMARK  Name = BDB009505
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.734  -1.075  -0.192  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.831  -1.664  -1.452  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.870  -1.411  -2.263  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.151  -2.541  -1.910  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        1.253  -2.836  -1.107  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        1.384  -2.251   0.160  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        0.377  -1.383   0.613  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  10
ATOM      8  N   LIG    1       -2.869   0.110  -0.413  0.00  0.00    -0.307 N 
ATOM      9  H   LIG    1       -3.069  -0.498  -1.204  0.00  0.00    +0.149 HD
ATOM     10  C   LIG    1       -1.745  -0.120   0.344  0.00  0.00    +0.247 C 
ATOM     11  O   LIG    1       -1.551   0.418   1.430  0.00  0.00    -0.270 OA
BRANCH   8  13
ATOM     12  C   LIG    1       -5.213   0.736  -0.880  0.00  0.00    +0.071 C 
ATOM     13  C   LIG    1       -4.001   0.891   0.072  0.00  0.00    +0.090 C 
ATOM     14  C   LIG    1       -3.647   2.379   0.249  0.00  0.00    +0.024 C 
ATOM     15  C   LIG    1       -4.844   3.319   0.072  0.00  0.00    +0.002 C 
ATOM     16  C   LIG    1       -6.150   2.670   0.512  0.00  0.00    +0.002 C 
ATOM     17  C   LIG    1       -6.463   1.392  -0.275  0.00  0.00    +0.020 C 
BRANCH  12  18
ATOM     18  N   LIG    1       -5.473  -0.672  -1.224  0.00  0.00    -0.326 NA
ATOM     19  H   LIG    1       -6.329  -0.733  -1.776  0.00  0.00    +0.119 HD
ATOM     20  H   LIG    1       -5.652  -1.200  -0.370  0.00  0.00    +0.119 HD
ENDBRANCH  12  18
ENDBRANCH   8  13
ENDBRANCH   1  10
BRANCH   6  21
ATOM     21  C   LIG    1        2.572  -2.571   1.040  0.00  0.00    +0.094 C 
BRANCH  21  22
ATOM     22  C   LIG    1        3.909  -2.258   0.379  0.00  0.00    +0.087 A 
ATOM     23  C   LIG    1        4.420  -0.843   0.400  0.00  0.00    +0.059 A 
ATOM     24  N   LIG    1        3.684   0.194   0.964  0.00  0.00    -0.342 N 
ATOM     25  H   LIG    1        2.677   0.051   0.941  0.00  0.00    +0.146 HD
ATOM     26  C   LIG    1        4.070   1.582   0.730  0.00  0.00    +0.102 C 
ATOM     27  C   LIG    1        5.590   1.703   0.800  0.00  0.00    +0.023 C 
ATOM     28  C   LIG    1        6.268   0.722  -0.166  0.00  0.00    +0.044 C 
ATOM     29  C   LIG    1        5.628  -0.640  -0.148  0.00  0.00    +0.041 A 
ATOM     30  C   LIG    1        6.366  -1.759  -0.772  0.00  0.00    +0.270 A 
ATOM     31  O   LIG    1        7.465  -1.597  -1.295  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1        5.745  -2.979  -0.745  0.00  0.00    -0.243 N 
ATOM     33  H   LIG    1        6.241  -3.760  -1.163  0.00  0.00    +0.192 HD
ATOM     34  N   LIG    1        4.541  -3.253  -0.173  0.00  0.00    -0.174 NA
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 5