REMARK  Name = LIG001003
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.312   0.864   0.695  0.00  0.00    +0.112 C 
ATOM      2  N   LIG    1       -1.599   1.031  -0.004  0.00  0.00    -0.276 N 
ATOM      3  C   LIG    1       -1.764   2.329  -0.479  0.00  0.00    +0.217 C 
ATOM      4  O   LIG    1       -2.703   2.751  -1.133  0.00  0.00    -0.276 OA
ATOM      5  C   LIG    1       -0.560   3.136  -0.076  0.00  0.00    +0.098 C 
ATOM      6  C   LIG    1        0.020   2.319   1.071  0.00  0.00    +0.044 C 
ATOM      7  C   LIG    1       -0.380  -0.001   1.959  0.00  0.00    +0.042 C 
ENDROOT
BRANCH   2   8
ATOM      8  C   LIG    1       -2.628   0.008  -0.234  0.00  0.00    +0.164 C 
ATOM      9  C   LIG    1       -3.455  -0.276   1.030  0.00  0.00    +0.240 C 
ATOM     10  O   LIG    1       -3.546   0.496   1.984  0.00  0.00    -0.273 OA
ATOM     11  N   LIG    1       -4.155  -1.460   1.040  0.00  0.00    -0.255 N 
ATOM     12  H   LIG    1       -4.688  -1.646   1.879  0.00  0.00    +0.158 HD
ATOM     13  C   LIG    1       -4.055  -2.502   0.155  0.00  0.00    +0.219 C 
ATOM     14  O   LIG    1       -4.612  -3.574   0.374  0.00  0.00    -0.275 OA
ATOM     15  C   LIG    1       -3.270  -2.240  -1.106  0.00  0.00    +0.098 C 
ATOM     16  C   LIG    1       -2.111  -1.289  -0.852  0.00  0.00    +0.041 C 
ENDBRANCH   2   8
BRANCH   1  19
ATOM     17  N   LIG    1        2.052   0.182   0.284  0.00  0.00    -0.309 N 
ATOM     18  H   LIG    1        2.204   0.545   1.216  0.00  0.00    +0.149 HD
ATOM     19  C   LIG    1        0.796   0.331  -0.277  0.00  0.00    +0.237 C 
ATOM     20  O   LIG    1        0.569   0.084  -1.458  0.00  0.00    -0.273 OA
BRANCH  17  22
ATOM     21  C   LIG    1        3.615   0.762  -1.549  0.00  0.00    +0.031 C 
ATOM     22  C   LIG    1        3.254  -0.250  -0.451  0.00  0.00    +0.026 C 
ATOM     23  C   LIG    1        3.062  -1.649  -1.059  0.00  0.00    +0.031 C 
ATOM     24  C   LIG    1        4.422  -0.319   0.550  0.00  0.00    +0.031 C 
ENDBRANCH  17  22
ENDBRANCH   1  19
TORSDOF 3