REMARK  Name = LIG001440
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.181  -0.393   0.389  0.00  0.00    +0.165 A 
ATOM      2  S   LIG    1        0.844  -1.657  -0.112  0.00  0.00    -0.046 S 
ATOM      3  C   LIG    1        1.689  -1.557   1.371  0.00  0.00    +0.067 A 
ATOM      4  C   LIG    1        1.120  -0.573   2.152  0.00  0.00    +0.135 A 
ATOM      5  N   LIG    1        0.050   0.097   1.585  0.00  0.00    -0.232 NA
ENDROOT
BRANCH   1   8
ATOM      6  O   LIG    1       -1.000  -1.144  -2.343  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1       -1.557  -0.297  -1.651  0.00  0.00    +0.223 C 
ATOM      8  N   LIG    1       -1.199   0.102  -0.383  0.00  0.00    -0.264 N 
ATOM      9  H   LIG    1       -1.742   0.811   0.091  0.00  0.00    +0.157 HD
BRANCH   7  10
ATOM     10  C   LIG    1       -2.747   0.478  -2.200  0.00  0.00    +0.131 C 
BRANCH  10  11
ATOM     11  C   LIG    1       -3.989   0.373  -1.345  0.00  0.00    -0.038 A 
ATOM     12  C   LIG    1       -4.564   1.521  -0.778  0.00  0.00    +0.007 A 
ATOM     13  C   LIG    1       -5.708   1.416   0.014  0.00  0.00    +0.038 A 
ATOM     14  C   LIG    1       -6.279   0.169   0.235  0.00  0.00    +0.123 A 
ATOM     15  F   LIG    1       -7.378   0.072   0.995  0.00  0.00    -0.205 F 
ATOM     16  C   LIG    1       -5.729  -0.978  -0.322  0.00  0.00    +0.038 A 
ATOM     17  C   LIG    1       -4.585  -0.878  -1.115  0.00  0.00    +0.007 A 
ENDBRANCH  10  11
ENDBRANCH   7  10
ENDBRANCH   1   8
BRANCH   3  18
ATOM     18  S   LIG    1        3.040  -2.585   1.798  0.00  0.00    -0.112 S 
BRANCH  18  19
ATOM     19  C   LIG    1        4.323  -1.971   0.664  0.00  0.00    +0.111 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.759  -0.567   0.973  0.00  0.00    -0.019 A 
ATOM     21  C   LIG    1        5.587  -0.293   2.059  0.00  0.00    +0.115 A 
ATOM     22  N   LIG    1        6.008   0.946   2.400  0.00  0.00    -0.263 NA
ATOM     23  C   LIG    1        5.583   1.966   1.625  0.00  0.00    +0.111 A 
ATOM     24  C   LIG    1        4.758   1.805   0.526  0.00  0.00    +0.020 A 
ATOM     25  C   LIG    1        4.342   0.518   0.196  0.00  0.00    +0.007 A 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 6