REMARK  Name = BDB042488
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.089  -1.718   1.048  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.278  -2.352   0.315  0.00  0.00    +0.054 C 
BRANCH   2  10
ATOM      3  C   LIG    1       -6.525   0.362   2.067  0.00  0.00    +0.044 C 
ATOM      4  C   LIG    1       -6.269   0.696   0.622  0.00  0.00    -0.040 A 
ATOM      5  C   LIG    1       -5.206   0.124  -0.110  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -5.030   0.489  -1.461  0.00  0.00    +0.049 A 
ATOM      7  C   LIG    1       -3.916  -0.109  -2.236  0.00  0.00    +0.257 A 
ATOM      8  N   LIG    1       -3.108  -0.997  -1.564  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1       -2.364  -1.398  -2.122  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1       -3.260  -1.355  -0.246  0.00  0.00    +0.020 A 
ATOM     11  O   LIG    1       -3.720   0.171  -3.413  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -5.884   1.401  -2.085  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1       -6.921   1.953  -1.354  0.00  0.00    +0.124 A 
ATOM     14  F   LIG    1       -7.749   2.829  -1.938  0.00  0.00    -0.205 F 
ATOM     15  C   LIG    1       -4.266  -0.843   0.481  0.00  0.00    +0.030 A 
ATOM     16  C   LIG    1       -7.121   1.613  -0.019  0.00  0.00    +0.042 A 
ENDBRANCH   2  10
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1       -0.209  -0.845   0.141  0.00  0.00    +0.085 C 
BRANCH  17  18
ATOM     18  N   LIG    1        0.959  -0.323   0.862  0.00  0.00    -0.299 NA
ATOM     19  C   LIG    1        1.493   0.880   0.187  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        2.934   1.246   0.607  0.00  0.00    +0.120 C 
ATOM     21  N   LIG    1        3.869   0.155   0.278  0.00  0.00    -0.327 N 
ATOM     22  C   LIG    1        3.282  -1.192   0.175  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        2.023  -1.331   1.067  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1        5.212   0.392   0.052  0.00  0.00    +0.033 A 
ATOM     25  C   LIG    1        5.845   1.558   0.511  0.00  0.00    +0.062 A 
ATOM     26  C   LIG    1        7.203   1.794   0.283  0.00  0.00    +0.142 A 
ATOM     27  F   LIG    1        7.744   2.926   0.755  0.00  0.00    -0.204 F 
ATOM     28  C   LIG    1        7.981   0.879  -0.412  0.00  0.00    +0.087 A 
ATOM     29  C   LIG    1        7.384  -0.288  -0.882  0.00  0.00    +0.023 A 
ATOM     30  C   LIG    1        6.020  -0.521  -0.649  0.00  0.00    +0.024 A 
BRANCH  28  31
ATOM     31  C   LIG    1        9.370   1.130  -0.640  0.00  0.00    +0.102 C 
ATOM     32  N   LIG    1       10.500   1.302  -0.844  0.00  0.00    -0.191 NA
ENDBRANCH  28  31
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 6