REMARK  Name = BDB052928
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.659   0.259   0.202  0.00  0.00    +0.000 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        2.131   0.518   0.281  0.00  0.00    +0.000 A 
ATOM      3  C   LIG    1        2.774   1.589   0.906  0.00  0.00    +0.000 A 
ATOM      4  C   LIG    1        2.059   2.697   1.612  0.00  0.00    +0.000 C 
ATOM      5  N   LIG    1        4.133   1.559   0.831  0.00  0.00    +0.000 NA
ATOM      6  C   LIG    1        4.592   0.480   0.156  0.00  0.00    +0.000 A 
ATOM      7  S   LIG    1        3.313  -0.483  -0.375  0.00  0.00    +0.000 S 
BRANCH   6   8
ATOM      8  C   LIG    1        6.031   0.210  -0.069  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1        6.452  -0.928  -0.779  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1        7.812  -1.175  -0.986  0.00  0.00    +0.000 A 
ATOM     11  F   LIG    1        8.184  -2.283  -1.677  0.00  0.00    +0.000 F 
ATOM     12  C   LIG    1        8.783  -0.288  -0.487  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        8.362   0.850   0.223  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1        7.001   1.095   0.430  0.00  0.00    +0.000 A 
BRANCH  12  15
ATOM     15  C   LIG    1       10.248  -0.570  -0.720  0.00  0.00    +0.000 C 
ATOM     16  F   LIG    1       10.578  -1.790  -0.158  0.00  0.00    +0.000 F 
ATOM     17  F   LIG    1       10.497  -0.618  -2.080  0.00  0.00    +0.000 F 
ATOM     18  F   LIG    1       11.054   0.405  -0.160  0.00  0.00    +0.000 F 
ENDBRANCH  12  15
ENDBRANCH   6   8
ENDBRANCH   1   2
BRANCH   1  19
ATOM     19 SE   LIG    1        0.058   0.418  -1.645  0.00  0.00    +0.000 Se
BRANCH  19  25
ATOM     20  C   LIG    1       -3.931  -3.065  -0.747  0.00  0.00    +0.000 C 
ATOM     21  C   LIG    1       -3.509  -1.620  -0.751  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -4.401  -0.583  -0.392  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -3.937   0.749  -0.410  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -2.623   1.040  -0.784  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -1.751   0.012  -1.141  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -2.192  -1.312  -1.125  0.00  0.00    +0.000 A 
BRANCH  22  27
ATOM     27  O   LIG    1       -5.716  -0.929  -0.018  0.00  0.00    +0.000 OA
BRANCH  27  28
ATOM     28  C   LIG    1       -6.832  -0.065   0.246  0.00  0.00    +0.000 C 
ATOM     29  C   LIG    1       -8.004  -0.961   0.671  0.00  0.00    +0.000 C 
ATOM     30  C   LIG    1       -7.237   0.684  -1.042  0.00  0.00    +0.000 C 
BRANCH  28  31
ATOM     31  C   LIG    1       -6.526   0.875   1.397  0.00  0.00    +0.000 C 
ATOM     32  O   LIG    1       -6.847   2.092   1.336  0.00  0.00    +0.000 OA
BRANCH  31  33
ATOM     33  O   LIG    1       -5.904   0.399   2.549  0.00  0.00    +0.000 OA
ATOM     34  H   LIG    1       -5.632  -0.573   2.638  0.00  0.00    +0.000 HD
ENDBRANCH  31  33
ENDBRANCH  28  31
ENDBRANCH  27  28
ENDBRANCH  22  27
ENDBRANCH  19  25
ENDBRANCH   1  19
TORSDOF 9