REMARK  Name = LIG001157
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.913   0.650   0.210  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -0.018  -0.115  -0.501  0.00  0.00    +0.036 A 
ATOM      3  C   LIG    1       -1.340   0.290  -0.477  0.00  0.00    +0.043 A 
ATOM      4  C   LIG    1       -2.502  -0.321  -1.127  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1       -3.623   0.393  -0.720  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -3.240   1.602   0.011  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1       -2.440  -1.269  -1.886  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -1.774   1.417   0.210  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1       -0.868   2.188   0.910  0.00  0.00    +0.008 A 
ATOM     10  C   LIG    1        0.480   1.796   0.907  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -4.938   0.228  -1.349  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -5.990   1.187  -0.766  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -6.005   2.391  -1.020  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -6.835   0.674   0.189  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -7.460   1.338   0.626  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -6.766  -0.556   0.790  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -7.423  -0.801   1.798  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -5.801  -1.551   0.193  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -5.484  -1.202  -1.253  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  21
ATOM     20  C   LIG    1        3.334   0.758   0.850  0.00  0.00    +0.248 C 
ATOM     21  N   LIG    1        2.256   0.219   0.169  0.00  0.00    -0.281 N 
ATOM     22  H   LIG    1        2.431  -0.622  -0.367  0.00  0.00    +0.155 HD
ATOM     23  O   LIG    1        3.304   1.667   1.670  0.00  0.00    -0.270 OA
BRANCH  20  28
ATOM     24  C   LIG    1        8.477  -1.721  -0.165  0.00  0.00    +0.044 C 
ATOM     25  C   LIG    1        7.133  -1.106   0.093  0.00  0.00    -0.050 A 
ATOM     26  C   LIG    1        6.212  -0.952  -0.952  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        4.973  -0.348  -0.722  0.00  0.00    +0.013 A 
ATOM     28  C   LIG    1        4.644   0.108   0.560  0.00  0.00    +0.037 A 
ATOM     29  C   LIG    1        5.574  -0.013   1.598  0.00  0.00    +0.013 A 
ATOM     30  C   LIG    1        6.811  -0.617   1.365  0.00  0.00    +0.004 A 
ENDBRANCH  20  28
ENDBRANCH   1  21
TORSDOF 3