REMARK  Name = BDB034469
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.442  -0.665   1.072  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        1.635   0.134   0.804  0.00  0.00    -0.343 N 
ATOM      3  H   LIG    1        1.874   0.730   1.594  0.00  0.00    +0.146 HD
BRANCH   2   4
ATOM      4  C   LIG    1        2.799  -0.413   0.231  0.00  0.00    +0.038 A 
ATOM      5  C   LIG    1        3.958   0.403   0.067  0.00  0.00    +0.021 A 
ATOM      6  C   LIG    1        5.105  -0.179  -0.528  0.00  0.00    +0.074 A 
ATOM      7  C   LIG    1        6.255   0.579  -0.683  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1        6.305   1.910  -0.280  0.00  0.00    +0.043 A 
ATOM      9  C   LIG    1        5.191   2.512   0.286  0.00  0.00    +0.021 A 
ATOM     10 CL   LIG    1        7.750   2.819  -0.494  0.00  0.00    -0.083 Cl
ATOM     11  N   LIG    1        5.136  -1.444  -0.964  0.00  0.00    -0.255 NA
ATOM     12  C   LIG    1        4.013  -2.176  -0.848  0.00  0.00    +0.113 A 
ATOM     13  C   LIG    1        4.026   1.765   0.455  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1        2.841  -1.710  -0.281  0.00  0.00    +0.043 A 
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -0.463  -0.713  -0.162  0.00  0.00    +0.034 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -1.735  -1.508   0.136  0.00  0.00    +0.083 C 
BRANCH  16  17
ATOM     17  N   LIG    1       -2.616  -1.676  -1.019  0.00  0.00    -0.312 NA
ATOM     18  H   LIG    1       -2.093  -2.087  -1.791  0.00  0.00    +0.122 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -3.265  -0.454  -1.498  0.00  0.00    +0.119 C 
BRANCH  19  22
ATOM     20  F   LIG    1       -5.905  -1.442  -1.132  0.00  0.00    -0.205 F 
ATOM     21  C   LIG    1       -5.529  -0.395  -0.384  0.00  0.00    +0.128 A 
ATOM     22  C   LIG    1       -4.248   0.146  -0.528  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -3.901   1.257   0.258  0.00  0.00    +0.008 A 
ATOM     24  C   LIG    1       -4.817   1.801   1.162  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -6.089   1.244   1.292  0.00  0.00    +0.003 A 
ATOM     26  C   LIG    1       -6.446   0.144   0.515  0.00  0.00    +0.038 A 
ENDBRANCH  19  22
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 7