REMARK  Name = BDB002282
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.200   0.218   0.535  0.00  0.00    +0.052 C 
ATOM      2  C   LIG    1        1.509   0.070   0.779  0.00  0.00    +0.058 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        2.455  -0.042  -0.362  0.00  0.00    +0.187 C 
ATOM      4  O   LIG    1        2.112   0.205  -1.513  0.00  0.00    -0.287 OA
BRANCH   3   5
ATOM      5  C   LIG    1        3.862  -0.426  -0.067  0.00  0.00    +0.022 A 
ATOM      6  C   LIG    1        4.210  -1.239   1.020  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1        5.548  -1.573   1.243  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        6.540  -1.107   0.382  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1        6.199  -0.312  -0.711  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        4.864   0.024  -0.939  0.00  0.00    +0.012 A 
ENDBRANCH   3   5
ENDBRANCH   2   3
BRANCH   1  11
ATOM     11  S   LIG    1       -0.935   0.370   1.838  0.00  0.00    -0.058 S 
BRANCH  11  15
ATOM     12  C   LIG    1       -5.548   2.407   1.123  0.00  0.00    +0.066 C 
ATOM     13  C   LIG    1       -4.537   1.395   0.675  0.00  0.00    +0.043 A 
ATOM     14  N   LIG    1       -3.370   1.348   1.347  0.00  0.00    -0.227 NA
ATOM     15  C   LIG    1       -2.468   0.441   0.935  0.00  0.00    +0.193 A 
ATOM     16  N   LIG    1       -2.654  -0.421  -0.080  0.00  0.00    -0.227 NA
ATOM     17  C   LIG    1       -3.830  -0.349  -0.734  0.00  0.00    +0.043 A 
ATOM     18  C   LIG    1       -4.044  -1.300  -1.873  0.00  0.00    +0.066 C 
ATOM     19  C   LIG    1       -4.813   0.556  -0.386  0.00  0.00    +0.046 A 
ENDBRANCH  11  15
ENDBRANCH   1  11
TORSDOF 4