REMARK  Name = BDB022465
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.338   0.227  -1.215  0.00  0.00    +0.002 A 
ATOM      2  C   LIG    1        0.972   0.386  -0.903  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1        0.112   1.181  -1.687  0.00  0.00    -0.035 A 
ATOM      4  C   LIG    1        0.639   1.825  -2.813  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        1.988   1.694  -3.136  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        2.825   0.909  -2.343  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        5.377  -0.948   0.435  0.00  0.00    +0.144 A 
ATOM      8  N   LIG    1        4.535  -0.211  -0.322  0.00  0.00    -0.229 NA
ATOM      9  C   LIG    1        3.235  -0.612  -0.399  0.00  0.00    +0.091 A 
ATOM     10  C   LIG    1        2.819  -1.764   0.264  0.00  0.00    +0.139 A 
ATOM     11  N   LIG    1        3.649  -2.534   1.008  0.00  0.00    -0.258 NA
ATOM     12  C   LIG    1        4.934  -2.104   1.066  0.00  0.00    +0.154 A 
BRANCH   7  14
ATOM     13  C   LIG    1        7.794  -0.782   1.166  0.00  0.00    +0.242 C 
ATOM     14  N   LIG    1        6.685  -0.466   0.447  0.00  0.00    -0.266 N 
ATOM     15  H   LIG    1        6.851   0.224  -0.276  0.00  0.00    +0.157 HD
ATOM     16  O   LIG    1        8.902  -0.409   0.786  0.00  0.00    -0.270 OA
BRANCH  13  18
ATOM     17  C   LIG    1        8.631  -2.288   2.904  0.00  0.00    +0.013 C 
ATOM     18  C   LIG    1        7.644  -1.504   2.451  0.00  0.00    +0.060 C 
ENDBRANCH  13  18
ENDBRANCH   7  14
ENDBRANCH   1   9
BRANCH   3  19
ATOM     19  C   LIG    1       -1.361   1.319  -1.291  0.00  0.00    +0.102 C 
ATOM     20  C   LIG    1       -1.767   2.789  -1.146  0.00  0.00    +0.022 C 
BRANCH  19  21
ATOM     21  C   LIG    1       -2.310   0.611  -2.266  0.00  0.00    +0.225 C 
ATOM     22  N   LIG    1       -3.531   0.144  -1.877  0.00  0.00    -0.268 N 
ATOM     23  H   LIG    1       -4.047  -0.278  -2.637  0.00  0.00    +0.156 HD
ATOM     24  O   LIG    1       -2.030   0.465  -3.463  0.00  0.00    -0.275 OA
BRANCH  22  25
ATOM     25  C   LIG    1       -4.147   0.144  -0.649  0.00  0.00    +0.147 A 
ATOM     26  N   LIG    1       -3.638   0.632   0.484  0.00  0.00    -0.158 NA
ATOM     27  N   LIG    1       -4.591   0.414   1.405  0.00  0.00    -0.280 N 
ATOM     28  H   LIG    1       -4.422   0.710   2.361  0.00  0.00    +0.189 HD
ATOM     29  C   LIG    1       -5.694  -0.197   0.898  0.00  0.00    +0.041 A 
ATOM     30  C   LIG    1       -5.441  -0.397  -0.434  0.00  0.00    +0.068 A 
BRANCH  29  31
ATOM     31  C   LIG    1       -6.960  -0.607   1.679  0.00  0.00    +0.037 C 
ATOM     32  C   LIG    1       -7.689   0.436   2.483  0.00  0.00    +0.010 C 
ATOM     33  C   LIG    1       -8.298  -0.096   1.219  0.00  0.00    +0.010 C 
ENDBRANCH  29  31
ENDBRANCH  22  25
ENDBRANCH  19  21
ENDBRANCH   3  19
TORSDOF 7