REMARK  Name = BDB057185
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.152  -0.064  -0.643  0.00  0.00    +0.064 A 
ATOM      2  C   LIG    1       -2.847  -0.463  -0.289  0.00  0.00    +0.102 A 
ATOM      3  C   LIG    1       -2.657  -1.726   0.269  0.00  0.00    +0.067 A 
ATOM      4  N   LIG    1       -1.306  -1.801   0.494  0.00  0.00    -0.337 N 
ATOM      5  H   LIG    1       -0.807  -2.583   0.891  0.00  0.00    +0.167 HD
ATOM      6  C   LIG    1       -0.728  -0.626   0.084  0.00  0.00    +0.146 A 
ATOM      7  C   LIG    1       -3.694  -2.632   0.501  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1       -4.982  -2.222   0.145  0.00  0.00    +0.003 A 
ATOM      9  N   LIG    1       -1.636   0.201  -0.394  0.00  0.00    -0.226 NA
ATOM     10  C   LIG    1       -5.211  -0.963  -0.417  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1        0.676  -0.342   0.166  0.00  0.00    +0.055 A 
ATOM     12  S   LIG    1        1.802  -1.446   0.848  0.00  0.00    -0.089 S 
ATOM     13  C   LIG    1        3.107  -0.399   0.555  0.00  0.00    +0.007 A 
ATOM     14  C   LIG    1        4.516  -0.724   0.950  0.00  0.00    +0.123 C 
ATOM     15  N   LIG    1        5.482   0.165   0.273  0.00  0.00    -0.311 NA
ATOM     16  H   LIG    1        6.390   0.060   0.723  0.00  0.00    +0.122 HD
ATOM     17  C   LIG    1        5.057   1.575   0.342  0.00  0.00    +0.086 C 
ATOM     18  C   LIG    1        3.723   1.828  -0.398  0.00  0.00    +0.051 C 
ATOM     19  C   LIG    1        2.713   0.781  -0.044  0.00  0.00    -0.034 A 
ATOM     20  C   LIG    1        1.306   0.810  -0.270  0.00  0.00    +0.023 A 
ENDBRANCH   6  11
BRANCH   1  24
ATOM     21  N   LIG    1       -3.382   2.101  -1.444  0.00  0.00    -0.325 N 
ATOM     22  H   LIG    1       -3.547   3.008  -1.854  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1       -2.434   1.823  -1.198  0.00  0.00    +0.145 HD
ATOM     24  C   LIG    1       -4.438   1.261  -1.240  0.00  0.00    +0.244 C 
ATOM     25  O   LIG    1       -5.578   1.595  -1.543  0.00  0.00    -0.270 OA
ENDBRANCH   1  24
TORSDOF 2