REMARK  Name = BDB008356
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.121   0.317   0.021  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.316  -0.685   0.967  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        1.355  -0.644   1.811  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.564  -1.760   1.045  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.666  -1.820   0.189  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.907  -0.794  -0.739  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.996   0.270  -0.824  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  15
ATOM      8  C   LIG    1        4.407  -0.181  -0.166  0.00  0.00    +0.239 C 
ATOM      9  N   LIG    1        5.171   1.044  -0.025  0.00  0.00    -0.278 N 
ATOM     10  C   LIG    1        4.629   2.299  -0.080  0.00  0.00    +0.153 A 
ATOM     11  N   LIG    1        5.603   3.179   0.015  0.00  0.00    -0.132 NA
ATOM     12  N   LIG    1        6.782   2.492   0.192  0.00  0.00    -0.125 NA
ATOM     13  C   LIG    1        3.175   2.558  -0.253  0.00  0.00    +0.184 C 
ATOM     14  N   LIG    1        2.391   1.320  -0.186  0.00  0.00    -0.286 N 
ATOM     15  C   LIG    1        1.012   1.489  -0.058  0.00  0.00    +0.250 C 
ATOM     16  O   LIG    1        0.476   2.595  -0.033  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1        6.512   1.198   0.200  0.00  0.00    +0.240 A 
ATOM     18  C   LIG    1        3.017   0.118  -0.766  0.00  0.00    +0.163 C 
BRANCH  17  19
ATOM     19  C   LIG    1        7.445   0.065   0.407  0.00  0.00    +0.452 C 
ATOM     20  F   LIG    1        8.751   0.426   0.330  0.00  0.00    -0.163 F 
ATOM     21  F   LIG    1        7.262  -0.905  -0.534  0.00  0.00    -0.163 F 
ATOM     22  F   LIG    1        7.272  -0.539   1.610  0.00  0.00    -0.163 F 
ENDBRANCH  17  19
BRANCH   8  24
ATOM     23  C   LIG    1        4.169  -2.170   1.117  0.00  0.00    +0.196 C 
ATOM     24  O   LIG    1        4.326  -0.759   1.135  0.00  0.00    -0.358 OA
ENDBRANCH   8  24
ENDBRANCH   1  15
BRANCH   6  25
ATOM     25  C   LIG    1       -3.110  -0.840  -1.656  0.00  0.00    +0.093 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -4.419  -1.116  -0.928  0.00  0.00    +0.074 A 
ATOM     27  C   LIG    1       -5.090  -0.033  -0.162  0.00  0.00    +0.011 A 
ATOM     28  C   LIG    1       -6.277  -0.359   0.491  0.00  0.00    +0.050 A 
ATOM     29  C   LIG    1       -6.970   0.601   1.238  0.00  0.00    +0.014 A 
ATOM     30  C   LIG    1       -6.469   1.898   1.332  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1       -5.282   2.232   0.682  0.00  0.00    +0.001 A 
ATOM     32  C   LIG    1       -6.800  -1.731   0.389  0.00  0.00    +0.272 A 
ATOM     33  O   LIG    1       -7.842  -2.063   0.943  0.00  0.00    -0.266 OA
ATOM     34  N   LIG    1       -6.056  -2.608  -0.361  0.00  0.00    -0.242 N 
ATOM     35  H   LIG    1       -6.405  -3.557  -0.446  0.00  0.00    +0.192 HD
ATOM     36  C   LIG    1       -4.592   1.272  -0.065  0.00  0.00    +0.010 A 
ATOM     37  N   LIG    1       -4.893  -2.325  -1.007  0.00  0.00    -0.175 NA
ENDBRANCH  25  26
ENDBRANCH   6  25
TORSDOF 5