REMARK  Name = BDB062429
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.432   1.425   0.378  0.00  0.00    +0.119 C 
ENDROOT
BRANCH   1  11
ATOM      2  C   LIG    1        5.713  -0.786  -0.306  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1        5.400   0.203  -1.387  0.00  0.00    +0.252 A 
ATOM      4  O   LIG    1        6.223   0.502  -2.247  0.00  0.00    -0.268 OA
ATOM      5  N   LIG    1        4.151   0.762  -1.378  0.00  0.00    -0.322 N 
ATOM      6  H   LIG    1        3.959   1.427  -2.114  0.00  0.00    +0.169 HD
ATOM      7  C   LIG    1        3.166   0.450  -0.435  0.00  0.00    +0.049 A 
ATOM      8  C   LIG    1        3.450  -0.484   0.567  0.00  0.00    -0.001 A 
ATOM      9  C   LIG    1        2.467  -0.799   1.507  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1        1.212  -0.184   1.443  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1        0.923   0.749   0.436  0.00  0.00    -0.031 A 
ATOM     12  C   LIG    1        1.918   1.068  -0.502  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        4.773  -1.106   0.602  0.00  0.00    +0.019 A 
BRANCH   2  15
ATOM     14  C   LIG    1        8.145  -0.477   0.247  0.00  0.00    +0.009 C 
ATOM     15  C   LIG    1        7.082  -1.409  -0.319  0.00  0.00    +0.037 C 
ENDBRANCH   2  15
ENDBRANCH   1  11
BRANCH   1  16
ATOM     16  N   LIG    1       -1.079   1.314  -0.939  0.00  0.00    -0.295 NA
ATOM     17  C   LIG    1       -1.496  -0.072  -1.256  0.00  0.00    +0.103 C 
ATOM     18  C   LIG    1       -2.697  -0.616  -0.444  0.00  0.00    +0.120 C 
ATOM     19  N   LIG    1       -3.848   0.316  -0.516  0.00  0.00    -0.325 N 
ATOM     20  C   LIG    1       -3.490   1.710  -0.179  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1       -2.279   2.182  -1.019  0.00  0.00    +0.103 C 
BRANCH  19  22
ATOM     22  C   LIG    1       -5.049  -0.201   0.005  0.00  0.00    +0.066 A 
ATOM     23  C   LIG    1       -5.795   0.383   1.052  0.00  0.00    +0.147 A 
ATOM     24  F   LIG    1       -5.366   1.496   1.669  0.00  0.00    -0.203 F 
ATOM     25  C   LIG    1       -6.989  -0.169   1.515  0.00  0.00    +0.078 A 
ATOM     26  C   LIG    1       -7.473  -1.324   0.926  0.00  0.00    +0.126 A 
ATOM     27  F   LIG    1       -8.619  -1.860   1.363  0.00  0.00    -0.205 F 
ATOM     28  C   LIG    1       -6.788  -1.929  -0.117  0.00  0.00    +0.040 A 
ATOM     29  C   LIG    1       -5.590  -1.367  -0.573  0.00  0.00    +0.029 A 
ENDBRANCH  19  22
ENDBRANCH   1  16
TORSDOF 4