REMARK  Name = LIG000252
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.082   1.179   1.020  0.00  0.00    +0.030 A 
ATOM      2  C   LIG    1       -0.600   0.046   1.482  0.00  0.00    +0.062 A 
ATOM      3  C   LIG    1       -1.272  -0.789   0.591  0.00  0.00    +0.137 A 
ATOM      4  F   LIG    1       -1.914  -1.864   1.070  0.00  0.00    -0.205 F 
ATOM      5  C   LIG    1       -1.309  -0.485  -0.763  0.00  0.00    +0.072 A 
ATOM      6  C   LIG    1       -0.647   0.643  -1.245  0.00  0.00    +0.018 A 
ATOM      7  C   LIG    1        0.027   1.479  -0.349  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   5   8
ATOM      8  C   LIG    1       -1.977  -1.395  -1.694  0.00  0.00    +0.247 C 
ATOM      9  N   LIG    1       -3.223  -1.107  -2.181  0.00  0.00    -0.300 N 
ATOM     10  H   LIG    1       -3.520  -1.792  -2.867  0.00  0.00    +0.150 HD
ATOM     11  O   LIG    1       -1.381  -2.402  -2.063  0.00  0.00    -0.270 OA
BRANCH   9  12
ATOM     12  C   LIG    1       -4.171  -0.041  -1.859  0.00  0.00    +0.160 C 
ATOM     13  C   LIG    1       -3.750   1.347  -2.364  0.00  0.00    +0.240 C 
ATOM     14  O   LIG    1       -2.976   1.529  -3.302  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -4.364   2.415  -1.750  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -4.115   3.331  -2.099  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -5.292   2.392  -0.738  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -5.802   3.429  -0.326  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -5.700   1.031  -0.221  0.00  0.00    +0.098 C 
ATOM     20  C   LIG    1       -4.579   0.016  -0.391  0.00  0.00    +0.041 C 
ENDBRANCH   9  12
ENDBRANCH   5   8
BRANCH   1  21
ATOM     21  N   LIG    1        0.734   2.014   1.937  0.00  0.00    -0.335 N 
ATOM     22  H   LIG    1        0.721   1.625   2.882  0.00  0.00    +0.147 HD
BRANCH  21  23
ATOM     23  C   LIG    1        2.112   2.431   1.614  0.00  0.00    +0.197 C 
BRANCH  23  26
ATOM     24  N   LIG    1        3.393   0.536   0.728  0.00  0.00    -0.314 N 
ATOM     25  H   LIG    1        2.712   0.580  -0.021  0.00  0.00    +0.149 HD
ATOM     26  C   LIG    1        3.095   1.278   1.857  0.00  0.00    +0.230 C 
ATOM     27  O   LIG    1        3.535   1.020   2.975  0.00  0.00    -0.274 OA
BRANCH  24  28
ATOM     28  C   LIG    1        4.154  -0.692   0.846  0.00  0.00    +0.104 C 
BRANCH  28  29
ATOM     29  C   LIG    1        4.619  -1.183  -0.521  0.00  0.00    +0.018 C 
BRANCH  29  31
ATOM     30  C   LIG    1        4.786  -3.656   0.076  0.00  0.00    +0.004 C 
ATOM     31  C   LIG    1        5.508  -2.425  -0.449  0.00  0.00    -0.002 C 
ENDBRANCH  29  31
ENDBRANCH  28  29
ENDBRANCH  24  28
ENDBRANCH  23  26
ENDBRANCH  21  23
ENDBRANCH   1  21
TORSDOF 8