REMARK  Name = BDB024074
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.432   0.151   0.608  0.00  0.00    +0.250 C 
ATOM      2  N   LIG    1        1.470  -0.159  -0.332  0.00  0.00    -0.280 N 
ATOM      3  H   LIG    1        1.796  -0.479  -1.238  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1        2.223   0.526   1.756  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   7
ATOM      5  C   LIG    1        6.093   1.027   0.403  0.00  0.00    +0.053 A 
ATOM      6  C   LIG    1        4.737   1.005   0.745  0.00  0.00    +0.033 A 
ATOM      7  C   LIG    1        3.855   0.074   0.159  0.00  0.00    +0.057 A 
ATOM      8  C   LIG    1        4.363  -0.852  -0.765  0.00  0.00    +0.053 A 
ATOM      9 CL   LIG    1        3.408  -2.083  -1.512  0.00  0.00    -0.083 Cl
ATOM     10  C   LIG    1        5.722  -0.826  -1.106  0.00  0.00    +0.022 A 
ATOM     11  C   LIG    1        6.583   0.110  -0.528  0.00  0.00    +0.020 A 
BRANCH   5  13
ATOM     12  N   LIG    1        7.695   2.760   1.480  0.00  0.00    -0.191 NA
ATOM     13  C   LIG    1        6.975   1.985   1.004  0.00  0.00    +0.099 C 
ENDBRANCH   5  13
ENDBRANCH   1   7
BRANCH   2  14
ATOM     14  C   LIG    1        0.069  -0.134  -0.163  0.00  0.00    +0.052 A 
ATOM     15  C   LIG    1       -0.740  -0.526  -1.226  0.00  0.00    +0.134 A 
ATOM     16  N   LIG    1       -2.095  -0.547  -1.204  0.00  0.00    -0.253 NA
ATOM     17  C   LIG    1       -2.714  -0.167  -0.058  0.00  0.00    +0.071 A 
ATOM     18  C   LIG    1       -1.980   0.248   1.052  0.00  0.00    +0.030 A 
ATOM     19  C   LIG    1       -0.582   0.263   0.997  0.00  0.00    +0.027 A 
BRANCH  17  20
ATOM     20  C   LIG    1       -4.192  -0.215  -0.080  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1       -4.951  -0.478   1.079  0.00  0.00    +0.013 A 
ATOM     22  C   LIG    1       -6.349  -0.517   1.038  0.00  0.00    +0.039 A 
ATOM     23  C   LIG    1       -7.007  -0.298  -0.164  0.00  0.00    +0.123 A 
ATOM     24  F   LIG    1       -8.345  -0.336  -0.202  0.00  0.00    -0.205 F 
ATOM     25  C   LIG    1       -6.295  -0.045  -1.327  0.00  0.00    +0.039 A 
ATOM     26  C   LIG    1       -4.898  -0.007  -1.283  0.00  0.00    +0.013 A 
ENDBRANCH  17  20
ENDBRANCH   2  14
TORSDOF 4