REMARK  Name = LIG001601
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1       -0.771   2.824   0.187  0.00  0.00    -0.155 S 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.201   2.012   1.499  0.00  0.00    +0.104 C 
BRANCH   2   6
ATOM      3  C   LIG    1        3.341  -0.595   0.062  0.00  0.00    +0.120 A 
ATOM      4  C   LIG    1        3.386   0.772  -0.209  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.372   1.615   0.259  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        1.296   1.105   0.999  0.00  0.00    -0.037 A 
ATOM      7  C   LIG    1        1.265  -0.267   1.277  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1        2.278  -1.107   0.808  0.00  0.00    +0.046 A 
BRANCH   3  10
ATOM      9  C   LIG    1        5.372  -1.052  -1.086  0.00  0.00    +0.277 C 
ATOM     10  O   LIG    1        4.260  -1.526  -0.336  0.00  0.00    -0.495 OA
ENDBRANCH   3  10
ENDBRANCH   2   6
ENDBRANCH   1   2
BRANCH   1  11
ATOM     11  C   LIG    1       -1.272   1.396  -0.848  0.00  0.00    +0.082 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -2.210   0.400  -0.156  0.00  0.00    +0.086 C 
ATOM     13  C   LIG    1       -3.665   0.849  -0.196  0.00  0.00    +0.223 C 
ATOM     14  O   LIG    1       -4.037   1.977  -0.502  0.00  0.00    -0.275 OA
ATOM     15  N   LIG    1       -4.586  -0.110   0.153  0.00  0.00    -0.256 N 
ATOM     16  H   LIG    1       -5.548   0.201   0.119  0.00  0.00    +0.157 HD
ATOM     17  C   LIG    1       -4.428  -1.464   0.001  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -5.396  -2.217  -0.027  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.009  -1.967  -0.099  0.00  0.00    +0.097 C 
ATOM     20  C   LIG    1       -2.125  -0.971  -0.836  0.00  0.00    +0.023 C 
ENDBRANCH  11  12
ENDBRANCH   1  11
TORSDOF 5