REMARK  Name = BDB007303
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.993   2.711   0.269  0.00  0.00    +0.171 C 
ATOM      2  N   LIG    1        2.445   1.729  -0.681  0.00  0.00    -0.283 N 
ATOM      3  N   LIG    1        2.203   0.431  -0.097  0.00  0.00    -0.246 N 
ATOM      4  C   LIG    1        2.911  -0.564  -0.783  0.00  0.00    +0.276 A 
ATOM      5  O   LIG    1        2.815  -1.770  -0.633  0.00  0.00    -0.266 OA
ATOM      6  C   LIG    1        3.734   0.093  -1.799  0.00  0.00    +0.078 A 
ATOM      7  C   LIG    1        4.650  -0.378  -2.734  0.00  0.00    +0.054 A 
ATOM      8  C   LIG    1        5.217   0.579  -3.598  0.00  0.00    +0.052 A 
ATOM      9  C   LIG    1        4.866   1.928  -3.511  0.00  0.00    +0.126 A 
ATOM     10  F   LIG    1        5.423   2.806  -4.355  0.00  0.00    -0.205 F 
ATOM     11  C   LIG    1        3.953   2.379  -2.569  0.00  0.00    +0.066 A 
ATOM     12  C   LIG    1        3.392   1.450  -1.705  0.00  0.00    +0.074 A 
ENDROOT
BRANCH   3  13
ATOM     13  C   LIG    1        0.850   0.120   0.384  0.00  0.00    +0.111 C 
ATOM     14  C   LIG    1        0.312   1.093   1.427  0.00  0.00    +0.042 C 
ATOM     15  C   LIG    1       -1.029   0.598   1.982  0.00  0.00    +0.087 C 
ATOM     16  N   LIG    1       -1.861  -0.139   1.010  0.00  0.00    -0.299 NA
ATOM     17  C   LIG    1       -1.592   0.321  -0.357  0.00  0.00    +0.087 C 
ATOM     18  C   LIG    1       -0.157  -0.026  -0.771  0.00  0.00    +0.042 C 
BRANCH  16  19
ATOM     19  C   LIG    1       -3.303  -0.128   1.369  0.00  0.00    +0.057 C 
ATOM     20  C   LIG    1       -3.572  -0.588   2.818  0.00  0.00    +0.019 C 
ATOM     21  C   LIG    1       -5.048  -0.449   3.209  0.00  0.00    +0.002 C 
ATOM     22  C   LIG    1       -6.011  -0.591   2.034  0.00  0.00    +0.000 C 
ATOM     23  C   LIG    1       -5.454  -1.530   0.979  0.00  0.00    +0.002 C 
ATOM     24  C   LIG    1       -4.129  -1.020   0.404  0.00  0.00    +0.019 C 
ENDBRANCH  16  19
ENDBRANCH   3  13
BRANCH   7  25
ATOM     25  C   LIG    1        5.113  -1.780  -2.925  0.00  0.00    +0.242 C 
ATOM     26  O   LIG    1        5.884  -2.061  -3.838  0.00  0.00    -0.270 OA
ATOM     27  N   LIG    1        4.696  -2.761  -2.083  0.00  0.00    -0.325 N 
ATOM     28  H   LIG    1        3.944  -2.646  -1.404  0.00  0.00    +0.145 HD
ATOM     29  H   LIG    1        4.969  -3.710  -2.299  0.00  0.00    +0.145 HD
ENDBRANCH   7  25
TORSDOF 3