REMARK  Name = LIG001648
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        4.763   0.386   0.202  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1        4.412   0.433  -1.139  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1        5.141   0.499  -2.110  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        2.948   0.365  -1.196  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1        2.471   0.188   0.097  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1        1.108   0.090   0.336  0.00  0.00    +0.028 A 
ATOM      7  C   LIG    1        0.215   0.148  -0.748  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1        0.737   0.368  -2.046  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1        2.111   0.462  -2.287  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1        3.611   0.124   1.055  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       10.129  -0.813   0.560  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        8.946  -0.487   0.523  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1        7.956  -1.429   0.397  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1        8.266  -2.387   0.306  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1        6.596  -1.246   0.499  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1        5.841  -2.216   0.540  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1        6.125   0.205   0.691  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1        7.133   1.182   0.085  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1        8.500   0.945   0.707  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1       -1.175   0.131  -0.595  0.00  0.00    -0.340 N 
ATOM     21  H   LIG    1       -1.653  -0.152  -1.448  0.00  0.00    +0.146 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -1.767  -0.467   0.593  0.00  0.00    +0.137 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.268  -0.532   0.421  0.00  0.00    -0.027 A 
ATOM     24  C   LIG    1       -4.032   0.644   0.542  0.00  0.00    +0.052 A 
ATOM     25  C   LIG    1       -5.408   0.529   0.359  0.00  0.00    +0.137 A 
ATOM     26  O   LIG    1       -6.300   1.554   0.443  0.00  0.00    -0.455 OA
ATOM     27  C   LIG    1       -7.532   1.029   0.200  0.00  0.00    +0.136 A 
ATOM     28  C   LIG    1       -7.443  -0.338  -0.042  0.00  0.00    +0.028 A 
ATOM     29  C   LIG    1       -8.628  -1.048  -0.315  0.00  0.00    +0.012 A 
ATOM     30  C   LIG    1       -9.845  -0.351  -0.330  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1       -9.891   1.023  -0.080  0.00  0.00    +0.004 A 
ATOM     32  C   LIG    1       -8.726   1.748   0.192  0.00  0.00    +0.047 A 
ATOM     33  C   LIG    1       -6.059  -0.663   0.061  0.00  0.00    +0.028 A 
ATOM     34  C   LIG    1       -5.286  -1.832  -0.069  0.00  0.00    +0.012 A 
ATOM     35  C   LIG    1       -3.897  -1.749   0.110  0.00  0.00    +0.006 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   7  20
TORSDOF 4