REMARK  Name = LIG001552
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.683  -1.240   0.515  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1       -0.552  -0.512   0.285  0.00  0.00    +0.256 C 
ATOM      3  O   LIG    1       -0.431   0.607  -0.181  0.00  0.00    -0.269 OA
ATOM      4  C   LIG    1        0.580  -1.322   0.725  0.00  0.00    +0.071 A 
ATOM      5  C   LIG    1        0.070  -2.521   1.188  0.00  0.00    +0.051 A 
ATOM      6  C   LIG    1        0.887  -3.520   1.672  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        2.261  -3.266   1.678  0.00  0.00    +0.003 A 
ATOM      8  C   LIG    1        2.781  -2.037   1.205  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1        1.937  -1.035   0.716  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -1.383  -2.470   1.038  0.00  0.00    +0.255 C 
ATOM     11  O   LIG    1       -2.131  -3.388   1.310  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1       -3.415   2.860  -1.676  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -3.402   1.740  -1.173  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1       -3.709   1.564   0.151  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -3.852   2.430   0.656  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -3.331   0.502   0.934  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1       -3.175   0.643   2.146  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1       -3.043  -0.813   0.212  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1       -3.391  -0.776  -1.273  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1       -2.983   0.518  -1.955  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   9  21
ATOM     21  N   LIG    1        2.357   0.221   0.228  0.00  0.00    -0.278 N 
ATOM     22  H   LIG    1        1.602   0.834  -0.075  0.00  0.00    +0.155 HD
ATOM     23  C   LIG    1        3.651   0.706   0.114  0.00  0.00    +0.286 C 
ATOM     24  O   LIG    1        4.648   0.062   0.428  0.00  0.00    -0.266 OA
BRANCH  23  25
ATOM     25  C   LIG    1        3.732   2.052  -0.420  0.00  0.00    +0.222 A 
ATOM     26  O   LIG    1        4.980   2.586  -0.585  0.00  0.00    -0.350 OA
ATOM     27  N   LIG    1        4.879   3.868  -1.101  0.00  0.00    -0.086 NA
ATOM     28  C   LIG    1        3.572   4.090  -1.239  0.00  0.00    +0.157 A 
ATOM     29  C   LIG    1        2.803   2.987  -0.829  0.00  0.00    +0.077 A 
ENDBRANCH  23  25
ENDBRANCH   9  21
TORSDOF 3