REMARK  Name = BDB064207
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.711   0.634  -0.364  0.00  0.00    +0.047 C 
ATOM      2  S   LIG    1       -1.699   1.642  -1.780  0.00  0.00    -0.120 S 
ATOM      3  C   LIG    1       -0.219   0.966  -2.593  0.00  0.00    +0.094 C 
ATOM      4  C   LIG    1        0.984   0.881  -1.649  0.00  0.00    +0.123 C 
ATOM      5  N   LIG    1        0.689   0.066  -0.457  0.00  0.00    -0.288 N 
ATOM      6  C   LIG    1       -0.595   0.032   0.088  0.00  0.00    +0.093 C 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1        1.807  -0.435   0.261  0.00  0.00    +0.156 A 
ATOM      8  C   LIG    1        3.169  -0.123  -0.001  0.00  0.00    +0.148 A 
ATOM      9  C   LIG    1        4.122  -0.712   0.816  0.00  0.00    +0.163 A 
ATOM     10  N   LIG    1        5.326  -0.251   0.369  0.00  0.00    -0.329 N 
ATOM     11  H   LIG    1        6.223  -0.494   0.762  0.00  0.00    +0.168 HD
ATOM     12  C   LIG    1        5.083   0.590  -0.679  0.00  0.00    +0.198 A 
ATOM     13  N   LIG    1        3.933  -1.554   1.839  0.00  0.00    -0.216 NA
ATOM     14  C   LIG    1        2.624  -1.789   2.019  0.00  0.00    +0.225 A 
ATOM     15  N   LIG    1        3.796   0.693  -0.933  0.00  0.00    -0.231 NA
ATOM     16  N   LIG    1        1.587  -1.294   1.314  0.00  0.00    -0.218 NA
ENDBRANCH   5   7
BRANCH   1  19
ATOM     17  C   LIG    1       -4.203  -0.771  -1.376  0.00  0.00    +0.150 C 
ATOM     18  N   LIG    1       -4.031  -0.116  -0.102  0.00  0.00    -0.333 N 
ATOM     19  C   LIG    1       -2.908   0.517   0.384  0.00  0.00    +0.076 A 
ATOM     20  C   LIG    1       -3.268   0.911   1.659  0.00  0.00    +0.139 A 
ATOM     21  N   LIG    1       -4.558   0.552   1.950  0.00  0.00    -0.243 NA
ATOM     22  C   LIG    1       -4.992  -0.058   0.871  0.00  0.00    +0.199 A 
ENDBRANCH   1  19
TORSDOF 2