REMARK  Name = LIG001067
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.186  -0.645   0.764  0.00  0.00    +0.246 C 
ATOM      2  N   LIG    1       -0.562  -0.061  -0.230  0.00  0.00    -0.300 N 
ATOM      3  H   LIG    1       -0.109   0.348  -1.043  0.00  0.00    +0.150 HD
ATOM      4  O   LIG    1       -0.294  -1.232   1.724  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -2.014  -0.152  -0.244  0.00  0.00    +0.160 C 
ATOM      6  C   LIG    1       -2.520   0.212  -1.643  0.00  0.00    +0.240 C 
ATOM      7  O   LIG    1       -1.789   0.244  -2.633  0.00  0.00    -0.273 OA
ATOM      8  N   LIG    1       -3.859   0.498  -1.741  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1       -4.181   0.754  -2.664  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1       -4.665   0.922  -0.715  0.00  0.00    +0.219 C 
ATOM     11  O   LIG    1       -5.742   1.464  -0.944  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -4.172   0.658   0.689  0.00  0.00    +0.098 C 
ATOM     13  C   LIG    1       -2.658   0.783   0.774  0.00  0.00    +0.041 C 
ENDBRANCH   2   5
BRANCH   1  18
ATOM     14  C   LIG    1        4.432  -0.474   0.211  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        3.851   0.095   1.348  0.00  0.00    +0.043 A 
ATOM     16  C   LIG    1        2.466   0.042   1.552  0.00  0.00    +0.055 A 
ATOM     17 CL   LIG    1        1.836   0.787   2.978  0.00  0.00    -0.083 Cl
ATOM     18  C   LIG    1        1.649  -0.549   0.586  0.00  0.00    +0.055 A 
ATOM     19  C   LIG    1        2.216  -1.070  -0.584  0.00  0.00    +0.016 A 
ATOM     20  C   LIG    1        3.599  -1.010  -0.774  0.00  0.00    +0.023 A 
BRANCH  14  21
ATOM     21  N   LIG    1        5.797  -0.307  -0.041  0.00  0.00    -0.358 N 
ATOM     22  H   LIG    1        6.368  -0.205   0.794  0.00  0.00    +0.142 HD
ATOM     23  H   LIG    1        6.189  -0.982  -0.691  0.00  0.00    +0.142 HD
ENDBRANCH  14  21
ENDBRANCH   1  18
TORSDOF 3