REMARK  Name = LIG000506
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.727  -1.446   1.549  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1        1.000  -0.753   0.837  0.00  0.00    +0.265 A 
ATOM      3  N   LIG    1        1.318   0.542   0.453  0.00  0.00    -0.256 N 
ATOM      4  C   LIG    1        0.476   1.381  -0.271  0.00  0.00    +0.333 A 
ATOM      5  O   LIG    1        0.772   2.549  -0.533  0.00  0.00    -0.246 OA
ATOM      6  N   LIG    1       -0.732   0.821  -0.675  0.00  0.00    -0.295 N 
ATOM      7  C   LIG    1       -1.084  -0.474  -0.365  0.00  0.00    +0.104 A 
ATOM      8  C   LIG    1       -0.300  -1.291   0.346  0.00  0.00    +0.063 A 
ENDROOT
BRANCH   8   9
ATOM      9  C   LIG    1       -0.750  -2.660   0.654  0.00  0.00    -0.011 A 
ATOM     10  C   LIG    1       -1.071  -3.559  -0.376  0.00  0.00    +0.009 A 
ATOM     11  C   LIG    1       -1.511  -4.851  -0.080  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -1.635  -5.259   1.246  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -1.314  -4.378   2.278  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -0.874  -3.086   1.983  0.00  0.00    +0.009 A 
ENDBRANCH   8   9
BRANCH   3  15
ATOM     15  C   LIG    1        2.612   1.068   0.860  0.00  0.00    +0.165 C 
BRANCH  15  16
ATOM     16  C   LIG    1        3.684   0.800  -0.176  0.00  0.00    -0.028 A 
ATOM     17  C   LIG    1        3.938   1.727  -1.198  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1        4.912   1.470  -2.163  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        5.640   0.282  -2.121  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        5.392  -0.651  -1.117  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        4.418  -0.395  -0.150  0.00  0.00    +0.005 A 
ENDBRANCH  15  16
ENDBRANCH   3  15
BRANCH   6  22
ATOM     22  C   LIG    1       -1.678   1.653  -1.423  0.00  0.00    +0.161 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.772   2.215  -0.543  0.00  0.00    -0.028 A 
ATOM     24  C   LIG    1       -2.512   3.301   0.305  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1       -3.514   3.814   1.130  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -4.786   3.245   1.118  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -5.057   2.164   0.281  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -4.056   1.650  -0.545  0.00  0.00    +0.005 A 
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 5