REMARK  Name = BDB059740
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.546  -0.626   0.111  0.00  0.00    +0.114 A 
ATOM      2  N   LIG    1        2.707   0.110   0.236  0.00  0.00    -0.325 N 
ATOM      3  C   LIG    1        2.837   1.420   0.842  0.00  0.00    +0.142 C 
ATOM      4  C   LIG    1        3.865   2.298   0.141  0.00  0.00    +0.126 C 
ATOM      5  N   LIG    1        5.231   1.913   0.431  0.00  0.00    -0.310 N 
ATOM      6  H   LIG    1        5.891   2.646   0.670  0.00  0.00    +0.149 HD
ATOM      7  C   LIG    1        5.869   0.762   0.047  0.00  0.00    +0.248 C 
ATOM      8  C   LIG    1        5.115  -0.396  -0.457  0.00  0.00    +0.080 A 
ATOM      9  C   LIG    1        5.801  -1.425  -1.104  0.00  0.00    +0.126 A 
ATOM     10  N   LIG    1        5.238  -2.554  -1.607  0.00  0.00    -0.260 NA
ATOM     11  C   LIG    1        3.899  -2.726  -1.464  0.00  0.00    +0.140 A 
ATOM     12  C   LIG    1        3.127  -1.758  -0.813  0.00  0.00    +0.108 A 
ATOM     13  O   LIG    1        7.093   0.710   0.129  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        3.739  -0.606  -0.324  0.00  0.00    +0.084 A 
ATOM     15  N   LIG    1        1.782  -1.744  -0.547  0.00  0.00    -0.230 NA
ENDROOT
BRANCH   1  19
ATOM     16  N   LIG    1       -2.573  -0.884  -0.338  0.00  0.00    -0.302 NA
ATOM     17  C   LIG    1       -2.078   0.488  -0.198  0.00  0.00    +0.085 C 
ATOM     18  C   LIG    1       -0.570   0.590  -0.421  0.00  0.00    +0.026 C 
ATOM     19  C   LIG    1        0.199  -0.208   0.644  0.00  0.00    +0.058 C 
ATOM     20  C   LIG    1       -0.616  -1.420   1.134  0.00  0.00    +0.026 C 
ATOM     21  C   LIG    1       -1.588  -1.906   0.061  0.00  0.00    +0.085 C 
BRANCH  16  22
ATOM     22  C   LIG    1       -3.882  -1.110   0.292  0.00  0.00    +0.084 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -5.044  -0.294  -0.301  0.00  0.00    +0.015 C 
BRANCH  23  25
ATOM     24  C   LIG    1       -6.519   1.744  -0.173  0.00  0.00    +0.004 C 
ATOM     25  C   LIG    1       -5.290   1.048   0.392  0.00  0.00    -0.002 C 
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH  16  22
ENDBRANCH   1  19
TORSDOF 4