REMARK  Name = BDB060534
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.993   0.227   0.760  0.00  0.00    +0.104 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1        3.301  -0.034   0.020  0.00  0.00    +0.120 A 
ATOM      3  C   LIG    1        2.727  -0.593   1.161  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1        1.351  -0.497   1.388  0.00  0.00    +0.008 A 
ATOM      5  C   LIG    1        0.515   0.169   0.475  0.00  0.00    -0.033 A 
ATOM      6  C   LIG    1        1.103   0.720  -0.674  0.00  0.00    +0.008 A 
ATOM      7  C   LIG    1        2.483   0.622  -0.898  0.00  0.00    +0.046 A 
BRANCH   2   9
ATOM      8  C   LIG    1        5.288   0.370  -1.219  0.00  0.00    +0.277 C 
ATOM      9  O   LIG    1        4.654  -0.198  -0.080  0.00  0.00    -0.495 OA
ENDBRANCH   2   9
ENDBRANCH   1   5
BRANCH   1  10
ATOM     10  C   LIG    1       -1.710  -1.108   0.537  0.00  0.00    +0.053 A 
ATOM     11  N   LIG    1       -2.549  -1.524   1.526  0.00  0.00    -0.259 NA
ATOM     12  C   LIG    1       -3.196  -2.696   1.350  0.00  0.00    +0.111 A 
ATOM     13  C   LIG    1       -3.051  -3.497   0.231  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1       -2.191  -3.071  -0.771  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1       -1.511  -1.865  -0.621  0.00  0.00    +0.024 A 
ENDBRANCH   1  10
BRANCH   1  16
ATOM     16  C   LIG    1       -1.701   1.446   0.165  0.00  0.00    +0.003 A 
ATOM     17  S   LIG    1       -2.579   1.389  -1.313  0.00  0.00    -0.101 S 
ATOM     18  C   LIG    1       -2.990   3.043  -1.220  0.00  0.00    +0.045 A 
ATOM     19  C   LIG    1       -2.475   3.642  -0.094  0.00  0.00    +0.008 A 
ATOM     20  C   LIG    1       -1.734   2.724   0.703  0.00  0.00    +0.012 A 
ENDBRANCH   1  16
TORSDOF 4