REMARK  Name = BDB028193
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.290  -0.257  -0.561  0.00  0.00    +0.001 A 
ATOM      2  C   LIG    1       -0.899   0.319  -0.087  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -2.063  -0.452   0.035  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -2.028  -1.800  -0.314  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -3.244  -2.615  -0.163  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -4.346  -1.967   0.335  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -5.200  -2.507   0.434  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -4.421  -0.650   0.665  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -3.252  -3.805  -0.456  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -0.850  -2.380  -0.800  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -3.358   0.089   0.525  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1        0.304  -1.607  -0.928  0.00  0.00    +0.011 A 
ENDROOT
BRANCH   1  16
ATOM     13  C   LIG    1        4.936   1.526   0.120  0.00  0.00    +0.086 C 
ATOM     14  C   LIG    1        3.547   1.377  -0.390  0.00  0.00    +0.108 A 
ATOM     15  N   LIG    1        2.665   0.401   0.026  0.00  0.00    -0.314 N 
ATOM     16  C   LIG    1        1.489   0.560  -0.685  0.00  0.00    +0.070 A 
ATOM     17  C   LIG    1        1.728   1.658  -1.487  0.00  0.00    +0.139 A 
ATOM     18  N   LIG    1        2.987   2.154  -1.292  0.00  0.00    -0.240 NA
BRANCH  15  19
ATOM     19  C   LIG    1        2.913  -0.568   1.083  0.00  0.00    +0.242 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.557  -1.783   0.580  0.00  0.00    +0.084 C 
ATOM     21  N   LIG    1        4.065  -2.753   0.195  0.00  0.00    -0.195 NA
ENDBRANCH  19  20
ENDBRANCH  15  19
ENDBRANCH   1  16
BRANCH  11  22
ATOM     22  C   LIG    1       -3.480   1.568   0.889  0.00  0.00    +0.136 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.650   2.368  -0.323  0.00  0.00    -0.325 NA
ATOM     24  H   LIG    1       -3.834   3.337  -0.068  0.00  0.00    +0.119 HD
ATOM     25  H   LIG    1       -2.805   2.369  -0.889  0.00  0.00    +0.119 HD
ENDBRANCH  22  23
ENDBRANCH  11  22
TORSDOF 5