REMARK  Name = LIG000446
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.154  -0.101   0.086  0.00  0.00    +0.040 A 
ATOM      2  C   LIG    1        0.935   0.701   0.471  0.00  0.00    +0.073 A 
ATOM      3  C   LIG    1        2.228   0.454  -0.002  0.00  0.00    +0.164 A 
ATOM      4  O   LIG    1        3.214   1.309   0.423  0.00  0.00    -0.485 OA
ATOM      5  C   LIG    1        4.388   1.192  -0.388  0.00  0.00    +0.270 C 
ATOM      6  C   LIG    1        4.748  -0.269  -0.599  0.00  0.00    +0.270 C 
ATOM      7  O   LIG    1        3.716  -0.947  -1.325  0.00  0.00    -0.485 OA
ATOM      8  C   LIG    1        2.473  -0.626  -0.847  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        1.418  -1.435  -1.244  0.00  0.00    +0.051 A 
ATOM     10  C   LIG    1        0.122  -1.180  -0.775  0.00  0.00    +0.027 A 
ENDROOT
BRANCH   1  11
ATOM     11  N   LIG    1       -1.487   0.147   0.601  0.00  0.00    -0.269 N 
ATOM     12  C   LIG    1       -1.850   1.430   1.086  0.00  0.00    +0.234 C 
ATOM     13  O   LIG    1       -1.237   2.458   0.792  0.00  0.00    -0.274 OA
BRANCH  12  14
ATOM     14  C   LIG    1       -3.086   1.474   1.982  0.00  0.00    +0.204 C 
ATOM     15 CL   LIG    1       -3.245   3.034   2.816  0.00  0.00    -0.116 Cl
ENDBRANCH  12  14
BRANCH  11  16
ATOM     16  C   LIG    1       -2.511  -0.903   0.431  0.00  0.00    +0.128 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -3.314  -0.729  -0.862  0.00  0.00    +0.138 C 
BRANCH  17  19
ATOM     18  N   LIG    1       -5.080  -2.660  -1.065  0.00  0.00    -0.197 NA
ATOM     19  C   LIG    1       -4.303  -1.804  -0.989  0.00  0.00    +0.064 C 
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH  11  16
ENDBRANCH   1  11
TORSDOF 5