REMARK  Name = LIG001748
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        3.516   0.402   0.441  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1        3.183  -0.943   0.380  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1        3.923  -1.907   0.396  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        1.722  -1.013   0.266  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1        1.232   0.285   0.169  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -0.130   0.510   0.039  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1       -1.002  -0.593   0.017  0.00  0.00    +0.034 A 
ATOM      8  C   LIG    1       -0.478  -1.898   0.114  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1        0.898  -2.119   0.238  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1        2.362   1.258   0.203  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1        8.903   0.915  -0.602  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        7.714   0.834  -0.307  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1        6.747   0.764  -1.278  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1        7.080   0.752  -2.233  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1        5.383   0.842  -1.119  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1        4.649   0.955  -2.101  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1        4.877   0.917   0.330  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1        5.870   0.250   1.281  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1        7.234   0.903   1.124  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1       -2.378  -0.313  -0.122  0.00  0.00    -0.281 N 
ATOM     21  H   LIG    1       -2.622   0.666  -0.197  0.00  0.00    +0.155 HD
ATOM     22  C   LIG    1       -3.427  -1.214  -0.073  0.00  0.00    +0.248 C 
ATOM     23  O   LIG    1       -3.360  -2.410   0.181  0.00  0.00    -0.270 OA
BRANCH  22  24
ATOM     24  C   LIG    1       -4.773  -0.620  -0.312  0.00  0.00    +0.038 A 
ATOM     25  C   LIG    1       -5.856  -1.124   0.432  0.00  0.00    +0.024 A 
ATOM     26  C   LIG    1       -7.133  -0.574   0.222  0.00  0.00    +0.021 A 
ATOM     27  C   LIG    1       -7.276   0.436  -0.722  0.00  0.00    +0.135 A 
ATOM     28  O   LIG    1       -8.573   0.842  -0.787  0.00  0.00    -0.463 OA
ATOM     29  C   LIG    1       -9.267   0.094   0.110  0.00  0.00    +0.196 A 
ATOM     30  C   LIG    1       -6.231   0.945  -1.490  0.00  0.00    +0.047 A 
ATOM     31  C   LIG    1       -8.432  -0.790   0.754  0.00  0.00    +0.049 A 
ATOM     32  C   LIG    1       -4.964   0.389  -1.270  0.00  0.00    +0.017 A 
ENDBRANCH  22  24
ENDBRANCH   7  20
TORSDOF 3