REMARK  Name = LIG000659
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.159   0.276  -0.573  0.00  0.00    -0.017 A 
ATOM      2  C   LIG    1        0.162   1.144  -0.084  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1       -1.139   0.680   0.032  0.00  0.00    -0.017 A 
ATOM      4  C   LIG    1       -2.365   1.387   0.501  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1       -3.376   0.339   0.457  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -2.890  -0.825  -0.113  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1       -3.503  -1.828  -0.420  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -1.454  -0.624  -0.334  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1       -0.515  -1.508  -0.823  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1        0.800  -1.047  -0.937  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -4.781   0.638   0.707  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -5.536   0.773  -0.615  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -5.252   1.635  -1.448  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -6.525  -0.143  -0.868  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -7.003  -0.043  -1.752  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -6.871  -1.250  -0.138  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -7.766  -1.997  -0.526  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -6.099  -1.518   1.129  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -5.481  -0.264   1.721  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  22
ATOM     20  C   LIG    1        4.934   0.461  -0.215  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1        3.606   0.036  -0.095  0.00  0.00    +0.054 A 
ATOM     22  C   LIG    1        2.552   0.735  -0.707  0.00  0.00    -0.014 A 
ATOM     23  C   LIG    1        2.867   1.883  -1.450  0.00  0.00    +0.009 A 
ATOM     24  C   LIG    1        4.189   2.313  -1.575  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1        5.222   1.604  -0.958  0.00  0.00    +0.045 A 
BRANCH  20  26
ATOM     26  O   LIG    1        5.844  -0.324   0.439  0.00  0.00    -0.492 OA
BRANCH  26  28
ATOM     27  C   LIG    1        8.034  -0.953   1.133  0.00  0.00    +0.048 C 
ATOM     28  C   LIG    1        7.216   0.054   0.345  0.00  0.00    +0.225 C 
ENDBRANCH  26  28
ENDBRANCH  20  26
ENDBRANCH   1  22
TORSDOF 4