REMARK  Name = BDB062420
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.125   0.575  -1.766  0.00  0.00    +0.023 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.192   1.670  -1.696  0.00  0.00    +0.075 C 
BRANCH   2  12
ATOM      3  O   LIG    1       -3.991   2.376   2.600  0.00  0.00    -0.267 OA
ATOM      4  C   LIG    1       -4.082   1.784   1.531  0.00  0.00    +0.259 A 
ATOM      5  C   LIG    1       -5.157   0.814   1.259  0.00  0.00    +0.066 A 
ATOM      6  C   LIG    1       -5.172   0.196   0.002  0.00  0.00    +0.096 A 
ATOM      7  C   LIG    1       -6.197  -0.727  -0.255  0.00  0.00    +0.067 A 
ATOM      8  C   LIG    1       -7.168  -1.017   0.714  0.00  0.00    +0.022 A 
ATOM      9  C   LIG    1       -7.129  -0.388   1.958  0.00  0.00    +0.002 A 
ATOM     10 CL   LIG    1       -6.307  -1.545  -1.776  0.00  0.00    -0.081 Cl
ATOM     11  N   LIG    1       -4.194   0.486  -0.974  0.00  0.00    -0.232 NA
ATOM     12  C   LIG    1       -3.270   1.343  -0.690  0.00  0.00    +0.110 A 
ATOM     13  C   LIG    1       -6.121   0.532   2.234  0.00  0.00    +0.015 A 
ATOM     14  N   LIG    1       -3.188   1.985   0.513  0.00  0.00    -0.310 N 
ATOM     15  H   LIG    1       -2.458   2.657   0.702  0.00  0.00    +0.170 HD
ENDBRANCH   2  12
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  C   LIG    1       -0.235   0.539  -0.515  0.00  0.00    +0.085 C 
BRANCH  16  17
ATOM     17  N   LIG    1        0.759  -0.544  -0.548  0.00  0.00    -0.299 NA
ATOM     18  C   LIG    1        1.819  -0.313  -1.559  0.00  0.00    +0.103 C 
ATOM     19  C   LIG    1        2.906  -1.417  -1.555  0.00  0.00    +0.120 C 
ATOM     20  N   LIG    1        3.520  -1.557  -0.214  0.00  0.00    -0.325 N 
ATOM     21  C   LIG    1        2.493  -1.780   0.825  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1        1.394  -0.691   0.789  0.00  0.00    +0.103 C 
BRANCH  20  23
ATOM     23  C   LIG    1        4.666  -0.801   0.052  0.00  0.00    +0.066 A 
ATOM     24  C   LIG    1        4.863  -0.002   1.200  0.00  0.00    +0.147 A 
ATOM     25  F   LIG    1        3.903   0.125   2.130  0.00  0.00    -0.203 F 
ATOM     26  C   LIG    1        6.039   0.716   1.422  0.00  0.00    +0.078 A 
ATOM     27  C   LIG    1        7.065   0.636   0.498  0.00  0.00    +0.126 A 
ATOM     28  F   LIG    1        8.198   1.320   0.705  0.00  0.00    -0.205 F 
ATOM     29  C   LIG    1        6.936  -0.151  -0.634  0.00  0.00    +0.040 A 
ATOM     30  C   LIG    1        5.751  -0.865  -0.846  0.00  0.00    +0.029 A 
ENDBRANCH  20  23
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 5