REMARK  Name = LIG001928
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -4.523   1.441   1.200  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -3.472   0.863   0.938  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1       -2.830   0.100   1.879  0.00  0.00    -0.256 N 
ATOM      4  H   LIG    1       -3.326  -0.009   2.754  0.00  0.00    +0.157 HD
ATOM      5  C   LIG    1       -1.809  -0.793   1.663  0.00  0.00    +0.223 C 
ATOM      6  O   LIG    1       -1.527  -1.631   2.515  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1       -1.051  -0.637   0.353  0.00  0.00    +0.086 C 
ATOM      8  C   LIG    1       -2.050  -0.302  -0.757  0.00  0.00    +0.023 C 
ATOM      9  C   LIG    1       -2.799   0.976  -0.406  0.00  0.00    +0.097 C 
ENDROOT
BRANCH   7  10
ATOM     10  C   LIG    1       -0.240  -1.914   0.081  0.00  0.00    +0.087 C 
BRANCH  10  11
ATOM     11  S   LIG    1        0.810  -1.832  -1.420  0.00  0.00    -0.124 S 
BRANCH  11  12
ATOM     12  C   LIG    1        1.978  -0.571  -0.946  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1        2.124   0.556  -1.764  0.00  0.00    +0.017 A 
ATOM     14  C   LIG    1        3.031   1.562  -1.422  0.00  0.00    +0.039 A 
ATOM     15  C   LIG    1        3.796   1.431  -0.269  0.00  0.00    +0.123 A 
ATOM     16  F   LIG    1        4.665   2.395   0.059  0.00  0.00    -0.205 F 
ATOM     17  C   LIG    1        3.675   0.311   0.545  0.00  0.00    +0.039 A 
ATOM     18  C   LIG    1        2.768  -0.695   0.204  0.00  0.00    +0.017 A 
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   7  10
TORSDOF 3