REMARK  Name = BDB021557
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.220  -1.733   1.831  0.00  0.00    +0.140 C 
ENDROOT
BRANCH   1   4
ATOM      2  O   LIG    1        2.283   0.784   2.068  0.00  0.00    -0.270 OA
ATOM      3  C   LIG    1        2.837   0.035   1.260  0.00  0.00    +0.250 C 
ATOM      4  N   LIG    1        2.388  -1.265   1.073  0.00  0.00    -0.292 N 
ATOM      5  C   LIG    1        2.890  -2.127   0.013  0.00  0.00    +0.149 C 
ATOM      6  C   LIG    1        2.771  -1.424  -1.326  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1        3.956  -0.709  -1.648  0.00  0.00    -0.490 OA
ATOM      8  C   LIG    1        4.462   0.202  -0.767  0.00  0.00    +0.135 A 
ATOM      9  C   LIG    1        5.604   0.829  -1.300  0.00  0.00    +0.084 A 
ATOM     10  C   LIG    1        6.290   1.800  -0.585  0.00  0.00    +0.127 A 
ATOM     11  F   LIG    1        7.372   2.378  -1.122  0.00  0.00    -0.205 F 
ATOM     12  C   LIG    1        5.866   2.177   0.674  0.00  0.00    +0.039 A 
ATOM     13  C   LIG    1        4.737   1.563   1.217  0.00  0.00    +0.019 A 
ATOM     14  C   LIG    1        4.019   0.564   0.515  0.00  0.00    +0.079 A 
ENDBRANCH   1   4
BRANCH   1  15
ATOM     15  C   LIG    1       -0.137  -1.551   1.121  0.00  0.00    +0.146 C 
BRANCH  15  16
ATOM     16  O   LIG    1       -0.172  -2.299  -0.106  0.00  0.00    -0.389 OA
ATOM     17  H   LIG    1       -0.911  -1.897  -0.610  0.00  0.00    +0.210 HD
ENDBRANCH  15  16
BRANCH  15  18
ATOM     18  C   LIG    1       -0.499  -0.080   0.822  0.00  0.00    +0.117 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -1.757   0.020   0.035  0.00  0.00    -0.295 NA
ATOM     20  C   LIG    1       -2.938  -0.289   0.872  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1       -4.261  -0.012   0.188  0.00  0.00    -0.030 A 
ATOM     22  C   LIG    1       -4.340   0.864  -0.908  0.00  0.00    -0.042 A 
ATOM     23  C   LIG    1       -5.580   1.126  -1.505  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -6.741   0.541  -1.001  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -6.671  -0.311   0.098  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -3.083   1.469  -1.476  0.00  0.00    +0.051 C 
ATOM     27  C   LIG    1       -5.439  -0.585   0.692  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -1.899   1.387  -0.503  0.00  0.00    +0.089 C 
ENDBRANCH  18  19
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 5