REMARK  Name = BDB019611
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.098   0.698   0.317  0.00  0.00    -0.013 A 
ATOM      2  C   LIG    1       -1.695  -0.501  -0.103  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1       -1.004  -1.715  -0.004  0.00  0.00    +0.038 A 
ATOM      4  C   LIG    1        0.306  -1.752   0.478  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1        0.921  -0.573   0.914  0.00  0.00    -0.029 A 
ATOM      6  C   LIG    1        0.213   0.640   0.826  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1       -3.646   4.089  -2.383  0.00  0.00    +0.045 C 
ATOM      8  C   LIG    1       -3.072   3.611  -1.087  0.00  0.00    -0.032 A 
ATOM      9  C   LIG    1       -2.384   2.396  -1.003  0.00  0.00    +0.017 A 
ATOM     10  C   LIG    1       -1.817   1.977   0.211  0.00  0.00    +0.037 A 
ATOM     11  C   LIG    1       -1.975   2.843   1.296  0.00  0.00    +0.221 A 
ATOM     12  F   LIG    1       -1.468   2.492   2.490  0.00  0.00    -0.183 F 
ATOM     13  N   LIG    1       -2.622   4.030   1.251  0.00  0.00    -0.227 NA
ATOM     14  C   LIG    1       -3.148   4.387   0.062  0.00  0.00    +0.117 A 
ENDBRANCH   1  10
BRANCH   3  15
ATOM     15  C   LIG    1       -1.625  -2.969  -0.482  0.00  0.00    +0.246 C 
ATOM     16  N   LIG    1       -2.863  -3.349   0.035  0.00  0.00    -0.304 N 
ATOM     17  C   LIG    1       -3.423  -2.857   1.287  0.00  0.00    +0.132 C 
ATOM     18  C   LIG    1       -3.516  -4.511  -0.542  0.00  0.00    +0.132 C 
ATOM     19  O   LIG    1       -1.016  -3.608  -1.337  0.00  0.00    -0.270 OA
ENDBRANCH   3  15
BRANCH   5  20
ATOM     20  C   LIG    1        2.343  -0.589   1.421  0.00  0.00    +0.139 C 
BRANCH  20  21
ATOM     21  N   LIG    1        3.235  -0.212   0.343  0.00  0.00    -0.313 N 
ATOM     22  H   LIG    1        3.026  -0.689  -0.526  0.00  0.00    +0.149 HD
BRANCH  21  23
ATOM     23  C   LIG    1        4.561  -0.110   0.574  0.00  0.00    +0.176 C 
ATOM     24  N   LIG    1        5.305   0.041  -0.552  0.00  0.00    -0.316 N 
ATOM     25  H   LIG    1        4.881   0.660  -1.232  0.00  0.00    +0.149 HD
ATOM     26  C   LIG    1        6.636   0.421  -0.126  0.00  0.00    +0.127 C 
ATOM     27  C   LIG    1        6.608   0.029   1.354  0.00  0.00    +0.163 C 
ATOM     28  N   LIG    1        5.171  -0.110   1.721  0.00  0.00    -0.255 NA
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH   5  20
TORSDOF 5