REMARK  Name = BDB015334
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1        0.163  -2.817  -0.707  0.00  0.00    +0.077 S 
ATOM      2  O   LIG    1       -0.920  -2.678   0.244  0.00  0.00    -0.150 OA
ATOM      3  O   LIG    1        0.700  -4.131  -1.005  0.00  0.00    -0.150 OA
ENDROOT
BRANCH   1   7
ATOM      4  C   LIG    1        3.615  -0.230   0.857  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        2.279   0.172   1.027  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        1.229  -0.618   0.554  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1        1.511  -1.813  -0.111  0.00  0.00    +0.109 A 
ATOM      8  C   LIG    1        2.830  -2.243  -0.270  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        3.875  -1.447   0.206  0.00  0.00    +0.010 A 
BRANCH   4  11
ATOM     10  C   LIG    1        5.492   0.276   2.477  0.00  0.00    +0.059 A 
ATOM     11  C   LIG    1        4.716   0.614   1.349  0.00  0.00    -0.001 A 
ATOM     12  C   LIG    1        5.011   1.813   0.673  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1        6.046   2.648   1.099  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        6.806   2.303   2.212  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1        6.530   1.121   2.900  0.00  0.00    +0.019 A 
BRANCH  10  17
ATOM     16  N   LIG    1        5.070  -1.888   3.849  0.00  0.00    -0.191 NA
ATOM     17  C   LIG    1        5.244  -0.922   3.230  0.00  0.00    +0.100 C 
ENDBRANCH  10  17
ENDBRANCH   4  11
ENDBRANCH   1   7
BRANCH   1  18
ATOM     18  N   LIG    1       -0.226  -2.075  -2.184  0.00  0.00    -0.172 N 
ATOM     19  C   LIG    1       -0.704  -0.753  -2.282  0.00  0.00    +0.201 C 
ATOM     20  N   LIG    1       -0.047  -0.001  -3.108  0.00  0.00    -0.253 NA
ATOM     21  C   LIG    1        1.042  -0.836  -3.670  0.00  0.00    +0.166 C 
ATOM     22  C   LIG    1        0.751  -2.278  -3.269  0.00  0.00    +0.158 C 
BRANCH  19  23
ATOM     23  N   LIG    1       -1.791  -0.387  -1.546  0.00  0.00    -0.300 N 
ATOM     24  C   LIG    1       -2.072   1.044  -1.329  0.00  0.00    +0.123 C 
ATOM     25  C   LIG    1       -3.581   1.353  -1.239  0.00  0.00    +0.103 C 
ATOM     26  N   LIG    1       -4.360   0.522  -0.293  0.00  0.00    -0.296 NA
ATOM     27  C   LIG    1       -3.826  -0.865  -0.244  0.00  0.00    +0.103 C 
ATOM     28  C   LIG    1       -2.977  -1.256  -1.469  0.00  0.00    +0.123 C 
BRANCH  26  29
ATOM     29  C   LIG    1       -4.324   1.108   1.056  0.00  0.00    +0.057 C 
ATOM     30  C   LIG    1       -5.363   0.400   1.970  0.00  0.00    +0.019 C 
ATOM     31  C   LIG    1       -5.742   1.805   2.485  0.00  0.00    +0.003 C 
ATOM     32  C   LIG    1       -5.262   2.344   1.121  0.00  0.00    +0.019 C 
ENDBRANCH  26  29
ENDBRANCH  19  23
ENDBRANCH   1  18
TORSDOF 6