REMARK  Name = BDB060206
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.469  -0.732   0.046  0.00  0.00    -0.192 N 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.300  -0.409  -0.724  0.00  0.00    +0.057 A 
ATOM      3  C   LIG    1       -0.921  -0.035  -0.176  0.00  0.00    -0.002 A 
ATOM      4  C   LIG    1       -1.289   0.239   1.245  0.00  0.00    +0.058 C 
ATOM      5  C   LIG    1       -2.824   0.299   1.167  0.00  0.00    +0.116 C 
ATOM      6  N   LIG    1       -3.179   0.572  -0.234  0.00  0.00    -0.299 N 
ATOM      7  C   LIG    1       -2.043   0.196  -0.987  0.00  0.00    +0.039 A 
ATOM      8  C   LIG    1       -1.960  -0.000  -2.358  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1       -0.747  -0.407  -2.918  0.00  0.00    +0.004 A 
ATOM     10  C   LIG    1        0.373  -0.616  -2.105  0.00  0.00    +0.025 A 
BRANCH   6  11
ATOM     11  C   LIG    1       -4.444   1.038  -0.595  0.00  0.00    +0.037 A 
ATOM     12  C   LIG    1       -5.587   0.741   0.173  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1       -6.856   1.210  -0.186  0.00  0.00    +0.122 A 
ATOM     14  C   LIG    1       -6.997   1.998  -1.327  0.00  0.00    +0.046 A 
ATOM     15  C   LIG    1       -5.885   2.318  -2.098  0.00  0.00    +0.005 A 
ATOM     16  C   LIG    1       -4.624   1.842  -1.730  0.00  0.00    +0.023 A 
BRANCH  13  17
ATOM     17  O   LIG    1       -8.024   0.970   0.486  0.00  0.00    -0.495 OA
ATOM     18  C   LIG    1       -7.942   0.175   1.661  0.00  0.00    +0.277 C 
ENDBRANCH  13  17
ENDBRANCH   6  11
ENDBRANCH   1   2
BRANCH   1  19
ATOM     19  S   LIG    1        2.104   0.530   1.006  0.00  0.00    +0.075 S 
ATOM     20  O   LIG    1        1.889   1.801   0.346  0.00  0.00    -0.150 OA
ATOM     21  O   LIG    1        1.669   0.316   2.371  0.00  0.00    -0.150 OA
BRANCH  19  25
ATOM     22  C   LIG    1        6.613  -0.193   0.797  0.00  0.00    +0.120 A 
ATOM     23  C   LIG    1        5.919  -0.429   1.990  0.00  0.00    +0.047 A 
ATOM     24  C   LIG    1        4.543  -0.207   2.073  0.00  0.00    +0.032 A 
ATOM     25  C   LIG    1        3.857   0.238   0.942  0.00  0.00    +0.109 A 
ATOM     26  C   LIG    1        4.540   0.492  -0.251  0.00  0.00    +0.032 A 
ATOM     27  C   LIG    1        5.919   0.272  -0.322  0.00  0.00    +0.047 A 
BRANCH  22  29
ATOM     28  C   LIG    1        8.726  -0.134  -0.292  0.00  0.00    +0.277 C 
ATOM     29  O   LIG    1        7.954  -0.457   0.858  0.00  0.00    -0.495 OA
ENDBRANCH  22  29
ENDBRANCH  19  25
ENDBRANCH   1  19
BRANCH   1  30
ATOM     30  C   LIG    1        1.451  -2.089   0.659  0.00  0.00    +0.251 C 
BRANCH  30  31
ATOM     31  C   LIG    1        2.803  -2.745   0.747  0.00  0.00    +0.324 C 
ATOM     32  O   LIG    1        3.250  -3.335   1.718  0.00  0.00    -0.249 OA
BRANCH  31  33
ATOM     33  O   LIG    1        3.518  -2.674  -0.395  0.00  0.00    -0.479 OA
ATOM     34  H   LIG    1        4.376  -3.094  -0.172  0.00  0.00    +0.295 HD
ENDBRANCH  31  33
ENDBRANCH  30  31
ENDBRANCH   1  30
TORSDOF 9