REMARK  Name = LIG000106
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.544  -1.955   0.796  0.00  0.00    +0.043 A 
ATOM      2  C   LIG    1        0.306  -1.694  -0.304  0.00  0.00    +0.150 A 
ATOM      3  C   LIG    1        0.894  -2.738  -1.038  0.00  0.00    +0.106 A 
ATOM      4  C   LIG    1        1.771  -2.387  -2.184  0.00  0.00    +0.197 A 
ATOM      5  C   LIG    1        1.980  -0.954  -2.442  0.00  0.00    +0.098 A 
ATOM      6  C   LIG    1        1.363  -0.061  -1.665  0.00  0.00    +0.141 A 
ATOM      7  O   LIG    1        2.316  -3.200  -2.919  0.00  0.00    -0.287 OA
ATOM      8  C   LIG    1        0.635  -4.063  -0.670  0.00  0.00    +0.135 A 
ATOM      9  C   LIG    1       -0.198  -4.345   0.412  0.00  0.00    +0.092 A 
ATOM     10  O   LIG    1        0.528  -0.373  -0.618  0.00  0.00    -0.454 OA
ATOM     11  C   LIG    1       -0.776  -3.299   1.131  0.00  0.00    +0.127 A 
ENDROOT
BRANCH   1  16
ATOM     12  C   LIG    1       -0.861   2.845   1.418  0.00  0.00    +0.105 C 
ATOM     13  N   LIG    1       -1.633   2.016   2.342  0.00  0.00    -0.303 NA
ATOM     14  C   LIG    1       -2.669   1.236   1.650  0.00  0.00    +0.116 C 
ATOM     15  C   LIG    1       -2.150   0.064   0.792  0.00  0.00    +0.136 C 
ATOM     16  C   LIG    1       -1.198  -0.835   1.617  0.00  0.00    +0.057 C 
ATOM     17  C   LIG    1       -0.145  -0.010   2.380  0.00  0.00    +0.026 C 
ATOM     18  C   LIG    1       -0.784   1.142   3.158  0.00  0.00    +0.085 C 
BRANCH  15  19
ATOM     19  O   LIG    1       -3.285  -0.687   0.338  0.00  0.00    -0.390 OA
ATOM     20  H   LIG    1       -2.952  -1.506  -0.068  0.00  0.00    +0.210 HD
ENDBRANCH  15  19
ENDBRANCH   1  16
BRANCH   6  21
ATOM     21  C   LIG    1        1.536   1.382  -1.879  0.00  0.00    +0.036 A 
ATOM     22  C   LIG    1        2.368   2.171  -1.067  0.00  0.00    +0.052 A 
ATOM     23 CL   LIG    1        3.276   1.497   0.241  0.00  0.00    -0.083 Cl
ATOM     24  C   LIG    1        2.485   3.545  -1.300  0.00  0.00    +0.021 A 
ATOM     25  C   LIG    1        1.777   4.142  -2.343  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1        0.950   3.369  -3.155  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        0.830   1.996  -2.925  0.00  0.00    +0.013 A 
ENDBRANCH   6  21
BRANCH   8  28
ATOM     28  O   LIG    1        1.187  -5.104  -1.360  0.00  0.00    -0.506 OA
ATOM     29  H   LIG    1        0.938  -5.956  -0.969  0.00  0.00    +0.292 HD
ENDBRANCH   8  28
BRANCH  11  30
ATOM     30  O   LIG    1       -1.594  -3.589   2.187  0.00  0.00    -0.506 OA
ATOM     31  H   LIG    1       -1.643  -4.550   2.320  0.00  0.00    +0.292 HD
ENDBRANCH  11  30
TORSDOF 5