REMARK  Name = LIG000679
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.469  -0.087   0.642  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1        1.307   0.772   1.302  0.00  0.00    +0.254 C 
ATOM      3  O   LIG    1        1.059   1.520   2.228  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        2.624   0.628   0.688  0.00  0.00    +0.049 A 
ATOM      5  C   LIG    1        2.506  -0.289  -0.340  0.00  0.00    +0.049 A 
ATOM      6  C   LIG    1        3.582  -0.645  -1.130  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        4.810  -0.039  -0.847  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        4.931   0.896   0.203  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        3.825   1.242   0.986  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1        1.112  -0.726  -0.382  0.00  0.00    +0.254 C 
ATOM     11  O   LIG    1        0.663  -1.498  -1.207  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  16
ATOM     12  C   LIG    1       -3.740   1.184  -1.393  0.00  0.00    +0.141 C 
ATOM     13  N   LIG    1       -3.027   0.377  -0.418  0.00  0.00    -0.244 N 
ATOM     14  C   LIG    1       -1.681   0.695  -0.202  0.00  0.00    +0.243 C 
ATOM     15  O   LIG    1       -1.117   1.626  -0.782  0.00  0.00    -0.273 OA
ATOM     16  C   LIG    1       -0.967  -0.126   0.878  0.00  0.00    +0.171 C 
ATOM     17  C   LIG    1       -1.542  -1.532   0.942  0.00  0.00    +0.041 C 
ATOM     18  C   LIG    1       -3.013  -1.421   1.289  0.00  0.00    +0.099 C 
ATOM     19  C   LIG    1       -3.767  -0.569   0.291  0.00  0.00    +0.222 C 
ATOM     20  O   LIG    1       -4.988  -0.691   0.184  0.00  0.00    -0.275 OA
ENDBRANCH   1  16
TORSDOF 1