REMARK  Name = LIG001466
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.835   0.450   0.117  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -0.804   0.105   0.983  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -0.796   0.112   2.198  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        0.348  -0.268   0.157  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1        0.020  -0.026  -1.175  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1        0.934  -0.289  -2.181  0.00  0.00    +0.008 A 
ATOM      7  C   LIG    1        2.186  -0.801  -1.818  0.00  0.00    +0.029 A 
ATOM      8  C   LIG    1        2.501  -1.025  -0.461  0.00  0.00    +0.112 A 
ATOM      9  C   LIG    1        1.573  -0.767   0.552  0.00  0.00    +0.042 A 
ATOM     10  C   LIG    1       -1.359   0.539  -1.263  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -6.064  -1.442  -0.692  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -5.263  -0.642  -0.216  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -5.063   0.582  -0.801  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -5.620   0.764  -1.625  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -4.015   1.445  -0.586  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -3.789   2.352  -1.387  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -3.065   1.108   0.576  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -3.843   0.291   1.615  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -4.404  -0.973   0.980  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   8  20
ATOM     20  S   LIG    1        4.092  -1.675  -0.026  0.00  0.00    +0.085 S 
ATOM     21  O   LIG    1        4.778  -2.083  -1.237  0.00  0.00    -0.148 OA
ATOM     22  O   LIG    1        3.934  -2.555   1.114  0.00  0.00    -0.148 OA
BRANCH  20  23
ATOM     23  N   LIG    1        4.930  -0.331   0.535  0.00  0.00    -0.206 N 
ATOM     24  C   LIG    1        5.544   0.571  -0.275  0.00  0.00    +0.222 A 
ATOM     25  N   LIG    1        5.952   1.613   0.419  0.00  0.00    -0.242 NA
ATOM     26  C   LIG    1        5.565   1.363   1.717  0.00  0.00    +0.132 A 
ATOM     27  C   LIG    1        4.900   0.161   1.809  0.00  0.00    +0.133 A 
ENDBRANCH  20  23
ENDBRANCH   8  20
TORSDOF 3