REMARK  Name = LIG000609
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.198   1.196   1.815  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1        0.742   0.161   1.648  0.00  0.00    +0.011 A 
ATOM      3  C   LIG    1        1.988   0.475   1.134  0.00  0.00    -0.018 A 
ATOM      4  C   LIG    1        3.149  -0.412   0.837  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1        4.170   0.530   0.398  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        3.663   1.815   0.261  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1        4.204   2.796  -0.210  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.292   1.788   0.782  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1        1.392   2.826   0.919  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1        0.133   2.520   1.440  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        5.417   0.070  -0.202  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        5.266  -0.127  -1.719  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        4.212  -0.462  -2.259  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        6.422  -0.028  -2.458  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        6.327  -0.193  -3.451  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        7.702   0.159  -2.000  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1        8.663   0.085  -2.761  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        7.868   0.363  -0.512  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        6.616   0.967   0.105  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1       -1.574   0.881   2.344  0.00  0.00    +0.140 C 
BRANCH  20  22
ATOM     21  C   LIG    1       -3.643  -0.181   1.572  0.00  0.00    +0.266 C 
ATOM     22  N   LIG    1       -2.420   0.382   1.293  0.00  0.00    -0.306 N 
ATOM     23  H   LIG    1       -2.308   0.738   0.347  0.00  0.00    +0.149 HD
ATOM     24  O   LIG    1       -4.050  -0.461   2.688  0.00  0.00    -0.268 OA
BRANCH  21  26
ATOM     25  N   LIG    1       -4.186   0.296  -0.731  0.00  0.00    -0.080 NA
ATOM     26  C   LIG    1       -4.495  -0.422   0.316  0.00  0.00    +0.171 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -5.556  -1.455   0.388  0.00  0.00    +0.009 A 
ATOM     28  C   LIG    1       -6.569  -1.363   1.349  0.00  0.00    +0.013 A 
ATOM     29  C   LIG    1       -7.558  -2.347   1.409  0.00  0.00    +0.039 A 
ATOM     30  C   LIG    1       -7.527  -3.409   0.511  0.00  0.00    +0.123 A 
ATOM     31  F   LIG    1       -8.477  -4.351   0.571  0.00  0.00    -0.205 F 
ATOM     32  C   LIG    1       -6.524  -3.510  -0.448  0.00  0.00    +0.039 A 
ATOM     33  C   LIG    1       -5.533  -2.530  -0.512  0.00  0.00    +0.013 A 
ENDBRANCH  26  27
BRANCH  25  35
ATOM     34  C   LIG    1       -4.668   0.895  -2.892  0.00  0.00    +0.313 C 
ATOM     35  O   LIG    1       -5.041   0.045  -1.814  0.00  0.00    -0.396 OA
ENDBRANCH  25  35
ENDBRANCH  21  26
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 6