REMARK  Name = BDB024067
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.807  -1.934  -1.840  0.00  0.00    +0.052 C 
ATOM      2  C   LIG    1        0.377  -0.964  -1.018  0.00  0.00    +0.012 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1       -1.010  -0.483  -1.009  0.00  0.00    -0.024 A 
ATOM      4  C   LIG    1       -1.249   0.893  -0.954  0.00  0.00    +0.015 A 
ATOM      5  C   LIG    1       -2.558   1.406  -0.921  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -2.728   2.897  -0.998  0.00  0.00    +0.047 C 
ATOM      7  C   LIG    1       -3.641   0.514  -0.845  0.00  0.00    +0.128 A 
ATOM      8  C   LIG    1       -3.422  -0.865  -1.007  0.00  0.00    -0.008 A 
ATOM      9  C   LIG    1       -4.539  -1.859  -1.168  0.00  0.00    +0.047 C 
ATOM     10  C   LIG    1       -2.103  -1.353  -1.045  0.00  0.00    +0.015 A 
BRANCH   7  11
ATOM     11  O   LIG    1       -4.920   0.995  -0.771  0.00  0.00    -0.475 OA
BRANCH  11  12
ATOM     12  C   LIG    1       -5.506   1.142   0.548  0.00  0.00    +0.200 C 
ATOM     13  C   LIG    1       -4.954   2.368   1.287  0.00  0.00    +0.067 C 
ATOM     14  C   LIG    1       -5.416  -0.085   1.467  0.00  0.00    +0.067 C 
BRANCH  12  15
ATOM     15  C   LIG    1       -6.997   1.389   0.267  0.00  0.00    +0.348 C 
ATOM     16  O   LIG    1       -7.676   2.325   0.663  0.00  0.00    -0.247 OA
BRANCH  15  17
ATOM     17  O   LIG    1       -7.577   0.428  -0.488  0.00  0.00    -0.478 OA
ATOM     18  H   LIG    1       -8.496   0.745  -0.609  0.00  0.00    +0.295 HD
ENDBRANCH  15  17
ENDBRANCH  12  15
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   2   3
BRANCH   1  19
ATOM     19  C   LIG    1        2.198  -2.456  -1.885  0.00  0.00    +0.189 C 
ATOM     20  O   LIG    1        2.431  -3.544  -2.402  0.00  0.00    -0.287 OA
BRANCH  19  26
ATOM     21  C   LIG    1        7.151  -0.193   1.568  0.00  0.00    +0.122 A 
ATOM     22  C   LIG    1        6.421   0.358   0.513  0.00  0.00    +0.074 A 
ATOM     23  C   LIG    1        5.378  -0.335  -0.090  0.00  0.00    +0.076 A 
ATOM     24  C   LIG    1        5.058  -1.626   0.386  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        4.003  -2.316  -0.223  0.00  0.00    +0.024 A 
ATOM     26  C   LIG    1        3.297  -1.712  -1.263  0.00  0.00    +0.059 A 
ATOM     27  C   LIG    1        3.702  -0.458  -1.682  0.00  0.00    +0.141 A 
ATOM     28 CL   LIG    1        3.002   0.377  -3.014  0.00  0.00    -0.061 Cl
ATOM     29  C   LIG    1        5.789  -2.187   1.443  0.00  0.00    +0.013 A 
ATOM     30  N   LIG    1        4.711   0.239  -1.106  0.00  0.00    -0.234 NA
ATOM     31  C   LIG    1        6.829  -1.468   2.029  0.00  0.00    +0.046 A 
BRANCH  21  33
ATOM     32  C   LIG    1        8.579   1.698   1.778  0.00  0.00    +0.277 C 
ATOM     33  O   LIG    1        8.191   0.405   2.226  0.00  0.00    -0.495 OA
ENDBRANCH  21  33
ENDBRANCH  19  26
ENDBRANCH   1  19
TORSDOF 8