REMARK  Name = BDB051482
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.487  -0.261   1.516  0.00  0.00    +0.075 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.000   0.494   0.280  0.00  0.00    +0.011 C 
BRANCH   2   3
ATOM      3  C   LIG    1       -0.123  -0.363  -0.640  0.00  0.00    +0.001 C 
BRANCH   3   4
ATOM      4  C   LIG    1        1.147  -0.946  -0.008  0.00  0.00    +0.000 C 
BRANCH   4   5
ATOM      5  C   LIG    1        2.113   0.122   0.509  0.00  0.00    +0.000 C 
BRANCH   5   6
ATOM      6  C   LIG    1        3.386  -0.459   1.137  0.00  0.00    +0.000 C 
BRANCH   6   7
ATOM      7  C   LIG    1        4.314  -1.129   0.120  0.00  0.00    -0.000 C 
BRANCH   7   8
ATOM      8  C   LIG    1        5.589  -1.702   0.747  0.00  0.00    -0.000 C 
BRANCH   8   9
ATOM      9  C   LIG    1        6.508  -0.691   1.441  0.00  0.00    -0.000 C 
BRANCH   9  10
ATOM     10  C   LIG    1        6.965   0.491   0.581  0.00  0.00    -0.000 C 
BRANCH  10  12
ATOM     11  C   LIG    1        8.281   1.279  -1.418  0.00  0.00    +0.004 C 
ATOM     12  C   LIG    1        7.761   0.070  -0.655  0.00  0.00    -0.003 C 
ENDBRANCH  10  12
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   7   8
ENDBRANCH   6   7
ENDBRANCH   5   6
ENDBRANCH   4   5
ENDBRANCH   3   4
ENDBRANCH   2   3
ENDBRANCH   1   2
BRANCH   1  13
ATOM     13  S   LIG    1       -2.611   0.747   2.537  0.00  0.00    -0.115 S 
BRANCH  13  14
ATOM     14  C   LIG    1       -4.010   0.876   1.534  0.00  0.00    +0.083 C 
ATOM     15  S   LIG    1       -4.921  -0.475   0.834  0.00  0.00    +0.087 S 
ATOM     16  O   LIG    1       -3.988  -1.169  -0.343  0.00  0.00    -0.137 OA
ATOM     17  N   LIG    1       -6.032   0.577   0.143  0.00  0.00    -0.218 N 
ATOM     18  C   LIG    1       -5.764   1.900   0.440  0.00  0.00    +0.252 C 
ATOM     19  O   LIG    1       -6.369   2.890   0.055  0.00  0.00    -0.270 OA
ATOM     20  C   LIG    1       -4.589   2.050   1.298  0.00  0.00    +0.093 C 
BRANCH  17  21
ATOM     21  C   LIG    1       -7.032   0.176  -0.882  0.00  0.00    +0.042 C 
ATOM     22  C   LIG    1       -7.255  -1.355  -0.942  0.00  0.00    +0.032 C 
ATOM     23  C   LIG    1       -6.571   0.644  -2.276  0.00  0.00    +0.032 C 
ATOM     24  C   LIG    1       -8.412   0.795  -0.567  0.00  0.00    +0.032 C 
ENDBRANCH  17  21
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 13