REMARK  Name = BDB018654
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.349   0.573   0.319  0.00  0.00    +0.002 A 
ATOM      2  C   LIG    1       -1.665  -0.476  -0.309  0.00  0.00    +0.033 A 
ATOM      3  C   LIG    1       -0.296  -0.639  -0.097  0.00  0.00    +0.037 A 
ATOM      4  N   LIG    1        0.378  -1.697  -0.715  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1       -0.146  -2.427  -1.181  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1        1.736  -1.883  -0.656  0.00  0.00    +0.225 C 
ATOM      7  C   LIG    1        2.556  -0.699  -0.164  0.00  0.00    +0.069 C 
ATOM      8  C   LIG    1        3.988  -1.115   0.181  0.00  0.00    +0.132 C 
ATOM      9  N   LIG    1        4.798   0.125  -0.003  0.00  0.00    -0.268 N 
ATOM     10  C   LIG    1        4.059   1.045  -0.906  0.00  0.00    +0.117 C 
ATOM     11  C   LIG    1        1.859  -0.043   1.039  0.00  0.00    +0.054 C 
ATOM     12  C   LIG    1        2.802   0.287  -1.316  0.00  0.00    +0.037 C 
ATOM     13  O   LIG    1        2.234  -2.925  -1.076  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1        0.404   0.223   0.752  0.00  0.00    -0.025 A 
ATOM     15  C   LIG    1       -0.279   1.267   1.384  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1       -1.646   1.447   1.157  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  19
ATOM     17  C   LIG    1       -4.615  -1.387   1.129  0.00  0.00    +0.173 C 
ATOM     18  N   LIG    1       -4.766  -0.123   0.445  0.00  0.00    -0.267 N 
ATOM     19  C   LIG    1       -3.776   0.768   0.096  0.00  0.00    +0.069 A 
ATOM     20  C   LIG    1       -4.445   1.842  -0.462  0.00  0.00    +0.049 A 
ATOM     21  C   LIG    1       -5.804   1.488  -0.439  0.00  0.00    +0.135 A 
ATOM     22  N   LIG    1       -6.004   0.287   0.104  0.00  0.00    -0.179 NA
ENDBRANCH   1  19
BRANCH   9  23
ATOM     23  C   LIG    1        6.112   0.206   0.240  0.00  0.00    +0.169 C 
ATOM     24  N   LIG    1        7.247   0.281   0.451  0.00  0.00    -0.174 NA
ENDBRANCH   9  23
TORSDOF 2