REMARK  Name = BDB059741
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.071  -0.463   0.310  0.00  0.00    +0.114 A 
ATOM      2  N   LIG    1       -2.215   0.210  -0.070  0.00  0.00    -0.325 N 
ATOM      3  C   LIG    1       -2.276   1.429  -0.852  0.00  0.00    +0.142 C 
ATOM      4  C   LIG    1       -3.496   1.497  -1.762  0.00  0.00    +0.126 C 
ATOM      5  N   LIG    1       -4.728   1.751  -1.046  0.00  0.00    -0.310 N 
ATOM      6  H   LIG    1       -5.356   2.459  -1.415  0.00  0.00    +0.149 HD
ATOM      7  C   LIG    1       -5.371   0.904  -0.181  0.00  0.00    +0.248 C 
ATOM      8  C   LIG    1       -4.685  -0.267   0.387  0.00  0.00    +0.080 A 
ATOM      9  C   LIG    1       -5.439  -1.260   1.014  0.00  0.00    +0.126 A 
ATOM     10  N   LIG    1       -4.939  -2.381   1.593  0.00  0.00    -0.260 NA
ATOM     11  C   LIG    1       -3.594  -2.562   1.595  0.00  0.00    +0.140 A 
ATOM     12  C   LIG    1       -2.752  -1.612   1.007  0.00  0.00    +0.108 A 
ATOM     13  O   LIG    1       -6.540   1.135   0.116  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1       -3.305  -0.483   0.405  0.00  0.00    +0.084 A 
ATOM     15  N   LIG    1       -1.384  -1.590   0.918  0.00  0.00    -0.230 NA
ENDROOT
BRANCH   1  19
ATOM     16  N   LIG    1        3.060   0.309  -0.270  0.00  0.00    -0.300 NA
ATOM     17  C   LIG    1        2.690  -0.398   0.956  0.00  0.00    +0.085 C 
ATOM     18  C   LIG    1        1.222  -0.120   1.297  0.00  0.00    +0.026 C 
ATOM     19  C   LIG    1        0.333   0.011   0.045  0.00  0.00    +0.058 C 
ATOM     20  C   LIG    1        0.949  -0.753  -1.128  0.00  0.00    +0.026 C 
ATOM     21  C   LIG    1        2.359  -0.236  -1.442  0.00  0.00    +0.085 C 
BRANCH  16  23
ATOM     22  C   LIG    1        5.323  -0.838  -0.354  0.00  0.00    +0.024 C 
ATOM     23  C   LIG    1        4.509   0.453  -0.507  0.00  0.00    +0.050 C 
ATOM     24  C   LIG    1        5.083   1.548   0.400  0.00  0.00    +0.024 C 
ENDBRANCH  16  23
ENDBRANCH   1  19
TORSDOF 2