REMARK  Name = LIG000185
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.173  -0.498   2.281  0.00  0.00    -0.029 A 
ATOM      2  C   LIG    1       -1.032  -1.164   2.030  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -2.177  -0.428   1.696  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1       -2.158   0.952   1.597  0.00  0.00    +0.100 A 
ATOM      5  N   LIG    1       -3.288   1.702   1.254  0.00  0.00    -0.131 NA
ATOM      6  N   LIG    1       -4.381   1.131   1.066  0.00  0.00    -0.061 NA
ATOM      7  N   LIG    1       -4.515  -0.226   1.172  0.00  0.00    -0.198 N 
ATOM      8  C   LIG    1       -0.950   1.614   1.837  0.00  0.00    +0.031 A 
ATOM      9  C   LIG    1       -3.456  -1.078   1.427  0.00  0.00    +0.278 A 
ATOM     10  O   LIG    1       -3.534  -2.303   1.429  0.00  0.00    -0.265 OA
ATOM     11  C   LIG    1        0.205   0.899   2.172  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   7  12
ATOM     12  C   LIG    1       -5.834  -0.791   0.889  0.00  0.00    +0.199 C 
ATOM     13  C   LIG    1       -6.953   0.093   1.440  0.00  0.00    +0.244 C 
ATOM     14  O   LIG    1       -7.175   0.215   2.644  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -7.662   0.837   0.526  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -8.366   1.451   0.913  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -7.398   1.007  -0.809  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -8.017   1.834  -1.474  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -6.279   0.180  -1.394  0.00  0.00    +0.099 C 
ATOM     20  C   LIG    1       -6.047  -1.092  -0.595  0.00  0.00    +0.046 C 
ENDBRANCH   7  12
BRANCH   1  21
ATOM     21  C   LIG    1        1.426  -1.268   2.618  0.00  0.00    +0.141 C 
BRANCH  21  25
ATOM     22  N   LIG    1        3.726  -1.167  -0.192  0.00  0.00    -0.269 N 
ATOM     23  H   LIG    1        3.487  -2.114  -0.445  0.00  0.00    +0.156 HD
ATOM     24  C   LIG    1        3.182  -0.716   0.992  0.00  0.00    +0.304 C 
ATOM     25  N   LIG    1        2.188  -1.571   1.426  0.00  0.00    -0.295 N 
ATOM     26  H   LIG    1        1.700  -2.082   0.707  0.00  0.00    +0.151 HD
ATOM     27  O   LIG    1        3.511   0.283   1.616  0.00  0.00    -0.252 OA
BRANCH  22  31
ATOM     28  C   LIG    1        6.642   0.609  -2.684  0.00  0.00    +0.120 A 
ATOM     29  C   LIG    1        6.142   1.327  -1.599  0.00  0.00    +0.047 A 
ATOM     30  C   LIG    1        5.175   0.758  -0.757  0.00  0.00    +0.027 A 
ATOM     31  C   LIG    1        4.701  -0.534  -0.987  0.00  0.00    +0.035 A 
ATOM     32  C   LIG    1        5.201  -1.248  -2.080  0.00  0.00    +0.027 A 
ATOM     33  C   LIG    1        6.164  -0.680  -2.920  0.00  0.00    +0.047 A 
BRANCH  28  35
ATOM     34  C   LIG    1        8.119   2.343  -3.358  0.00  0.00    +0.277 C 
ATOM     35  O   LIG    1        7.581   1.045  -3.576  0.00  0.00    -0.495 OA
ENDBRANCH  28  35
ENDBRANCH  22  31
ENDBRANCH  21  25
ENDBRANCH   1  21
TORSDOF 5