REMARK  Name = BDB061904
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.594  -0.610  -0.002  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.533  -1.575  -1.008  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.447  -1.611  -1.990  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.478  -2.532  -1.021  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        1.452  -2.531  -0.023  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        1.425  -1.567   0.995  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        0.389  -0.620   1.003  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  10
ATOM      8  N   LIG    1       -2.649   0.403  -0.893  0.00  0.00    -0.308 N 
ATOM      9  H   LIG    1       -2.620  -0.337  -1.590  0.00  0.00    +0.149 HD
ATOM     10  C   LIG    1       -1.650   0.439   0.058  0.00  0.00    +0.247 C 
ATOM     11  O   LIG    1       -1.607   1.296   0.937  0.00  0.00    -0.270 OA
BRANCH   8  14
ATOM     12  C   LIG    1       -5.872   1.560  -0.978  0.00  0.00    +0.121 C 
ATOM     13  C   LIG    1       -4.797   1.151  -2.014  0.00  0.00    +0.054 C 
ATOM     14  C   LIG    1       -3.741   1.387  -0.913  0.00  0.00    +0.078 C 
ATOM     15  C   LIG    1       -4.864   1.124   0.113  0.00  0.00    +0.054 C 
BRANCH  12  17
ATOM     16  C   LIG    1       -8.064   1.120  -0.042  0.00  0.00    +0.194 C 
ATOM     17  O   LIG    1       -7.109   0.822  -1.050  0.00  0.00    -0.380 OA
ENDBRANCH  12  17
ENDBRANCH   8  14
ENDBRANCH   1  10
BRANCH   6  18
ATOM     18  C   LIG    1        2.472  -1.566   2.087  0.00  0.00    +0.093 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.897  -1.499   1.550  0.00  0.00    +0.074 A 
ATOM     20  C   LIG    1        4.469  -0.200   1.112  0.00  0.00    +0.011 A 
ATOM     21  C   LIG    1        5.770  -0.216   0.611  0.00  0.00    +0.050 A 
ATOM     22  C   LIG    1        6.383   0.965   0.173  0.00  0.00    +0.014 A 
ATOM     23  C   LIG    1        5.687   2.171   0.237  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        4.387   2.195   0.739  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        6.500  -1.492   0.548  0.00  0.00    +0.272 A 
ATOM     26  O   LIG    1        7.646  -1.554   0.115  0.00  0.00    -0.266 OA
ATOM     27  N   LIG    1        5.825  -2.598   1.002  0.00  0.00    -0.242 N 
ATOM     28  H   LIG    1        6.316  -3.486   0.969  0.00  0.00    +0.192 HD
ATOM     29  C   LIG    1        3.777   1.015   1.177  0.00  0.00    +0.010 A 
ATOM     30  N   LIG    1        4.556  -2.620   1.488  0.00  0.00    -0.175 NA
ENDBRANCH  18  19
ENDBRANCH   6  18
TORSDOF 5