REMARK  Name = BDB009421
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.279  -0.606  -0.439  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -1.022  -1.671  -1.295  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.013  -2.495  -1.082  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.839  -1.894  -2.399  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.933  -1.057  -2.634  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -3.228   0.002  -1.758  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -2.382   0.228  -0.661  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  12
ATOM      8  C   LIG    1        3.731   0.071   0.209  0.00  0.00    +0.060 C 
ATOM      9  C   LIG    1        3.120  -0.177   1.613  0.00  0.00    +0.038 C 
ATOM     10  C   LIG    1        1.675   0.290   1.769  0.00  0.00    +0.109 C 
ATOM     11  N   LIG    1        0.879   0.016   0.584  0.00  0.00    -0.297 N 
ATOM     12  C   LIG    1       -0.446  -0.384   0.753  0.00  0.00    +0.249 C 
ATOM     13  O   LIG    1       -0.986  -0.540   1.845  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        1.417   0.489  -0.689  0.00  0.00    +0.109 C 
ATOM     15  C   LIG    1        2.836   1.047  -0.577  0.00  0.00    +0.038 C 
BRANCH   8  20
ATOM     16  C   LIG    1        9.199  -0.288  -0.278  0.00  0.00    +0.105 C 
ATOM     17  N   LIG    1        7.845  -0.357  -0.820  0.00  0.00    -0.303 NA
ATOM     18  C   LIG    1        7.266   0.996  -0.938  0.00  0.00    +0.099 C 
ATOM     19  C   LIG    1        5.722   0.975  -0.954  0.00  0.00    +0.100 C 
ATOM     20  N   LIG    1        5.143   0.510   0.326  0.00  0.00    -0.297 NA
ATOM     21  C   LIG    1        6.023  -0.506   0.953  0.00  0.00    +0.100 C 
ATOM     22  C   LIG    1        6.975  -1.241  -0.020  0.00  0.00    +0.099 C 
ENDBRANCH   8  20
ENDBRANCH   1  12
BRANCH   6  23
ATOM     23  C   LIG    1       -4.415   0.898  -2.042  0.00  0.00    +0.094 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -5.180   1.348  -0.805  0.00  0.00    +0.087 A 
ATOM     25  C   LIG    1       -6.076   0.363  -0.104  0.00  0.00    +0.059 A 
ATOM     26  N   LIG    1       -6.167  -0.964  -0.515  0.00  0.00    -0.342 N 
ATOM     27  H   LIG    1       -5.313  -1.314  -0.945  0.00  0.00    +0.146 HD
ATOM     28  C   LIG    1       -6.805  -1.951   0.354  0.00  0.00    +0.102 C 
ATOM     29  C   LIG    1       -8.058  -1.341   0.977  0.00  0.00    +0.023 C 
ATOM     30  C   LIG    1       -7.731  -0.033   1.709  0.00  0.00    +0.044 C 
ATOM     31  C   LIG    1       -6.781   0.838   0.935  0.00  0.00    +0.041 A 
ATOM     32  C   LIG    1       -6.621   2.243   1.370  0.00  0.00    +0.270 A 
ATOM     33  O   LIG    1       -7.250   2.701   2.318  0.00  0.00    -0.266 OA
ATOM     34  N   LIG    1       -5.723   2.994   0.659  0.00  0.00    -0.243 N 
ATOM     35  H   LIG    1       -5.601   3.960   0.944  0.00  0.00    +0.192 HD
ATOM     36  N   LIG    1       -5.015   2.582  -0.427  0.00  0.00    -0.174 NA
ENDBRANCH  23  24
ENDBRANCH   6  23
TORSDOF 4