REMARK  Name = BDB032929
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.808   0.315   0.554  0.00  0.00    +0.031 A 
ATOM      2  C   LIG    1       -1.001  -0.326  -0.400  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1        0.355  -0.566  -0.159  0.00  0.00    +0.134 A 
ATOM      4  C   LIG    1        0.942  -0.138   1.034  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1        0.142   0.441   2.020  0.00  0.00    +0.018 A 
ATOM      6  C   LIG    1       -1.222   0.654   1.781  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.379  -0.357   1.323  0.00  0.00    +0.256 C 
ATOM      8  N   LIG    1        3.327   0.154   0.422  0.00  0.00    -0.249 N 
ATOM      9  C   LIG    1        2.994   1.255  -0.483  0.00  0.00    +0.140 C 
ATOM     10  O   LIG    1        2.612  -0.972   2.363  0.00  0.00    -0.269 OA
BRANCH   8  11
ATOM     11  C   LIG    1        4.587  -0.460   0.443  0.00  0.00    +0.169 A 
ATOM     12  S   LIG    1        5.824   0.159  -0.587  0.00  0.00    -0.029 S 
ATOM     13  C   LIG    1        6.892  -1.037  -0.025  0.00  0.00    +0.166 A 
ATOM     14  C   LIG    1        6.259  -1.843   0.889  0.00  0.00    +0.152 A 
ATOM     15  N   LIG    1        4.940  -1.518   1.141  0.00  0.00    -0.231 NA
BRANCH  13  16
ATOM     16  N   LIG    1        8.293  -1.229  -0.428  0.00  0.00    -0.022 NA
ATOM     17  O   LIG    1        8.711  -0.426  -1.270  0.00  0.00    -0.143 OA
ENDBRANCH  13  16
ENDBRANCH   8  11
ENDBRANCH   4   7
BRANCH   1  18
ATOM     18  N   LIG    1       -3.172   0.452   0.283  0.00  0.00    -0.344 N 
ATOM     19  H   LIG    1       -3.353   0.518  -0.716  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -3.991   1.352   1.088  0.00  0.00    +0.101 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -5.427   1.397   0.559  0.00  0.00    +0.018 C 
BRANCH  21  23
ATOM     22  C   LIG    1       -7.005   2.260  -1.207  0.00  0.00    +0.004 C 
ATOM     23  C   LIG    1       -5.557   2.182  -0.749  0.00  0.00    -0.002 C 
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  18  20
ENDBRANCH   1  18
BRANCH   3  24
ATOM     24  O   LIG    1        1.084  -1.175  -1.147  0.00  0.00    -0.491 OA
BRANCH  24  25
ATOM     25  C   LIG    1        1.162  -2.588  -0.910  0.00  0.00    +0.226 C 
ATOM     26  C   LIG    1        2.133  -3.175  -1.917  0.00  0.00    +0.048 C 
ENDBRANCH  24  25
ENDBRANCH   3  24
TORSDOF 9