REMARK  Name = LIG001770
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.881   3.030  -0.533  0.00  0.00    +0.173 C 
ATOM      2  N   LIG    1        1.211   1.763  -0.354  0.00  0.00    -0.265 N 
ATOM      3  C   LIG    1        1.806   0.537  -0.257  0.00  0.00    +0.072 A 
ATOM      4  C   LIG    1        0.756  -0.362  -0.075  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1        1.094  -1.713   0.151  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1        2.439  -2.115   0.121  0.00  0.00    +0.023 A 
ATOM      7  C   LIG    1        3.462  -1.211  -0.156  0.00  0.00    +0.027 A 
ATOM      8  C   LIG    1       -0.437   0.439  -0.114  0.00  0.00    +0.158 A 
ATOM      9  C   LIG    1        3.157   0.147  -0.289  0.00  0.00    +0.050 A 
ATOM     10  N   LIG    1       -0.123   1.740  -0.225  0.00  0.00    -0.155 NA
ENDROOT
BRANCH   8  11
ATOM     11  N   LIG    1       -1.787   0.063   0.004  0.00  0.00    -0.237 N 
ATOM     12  C   LIG    1       -2.229  -1.186  -0.417  0.00  0.00    +0.314 C 
ATOM     13  O   LIG    1       -1.564  -2.073  -0.944  0.00  0.00    -0.252 OA
ATOM     14  N   LIG    1       -3.573  -1.427  -0.229  0.00  0.00    -0.240 N 
ATOM     15  H   LIG    1       -3.898  -2.327  -0.549  0.00  0.00    +0.159 HD
ATOM     16  C   LIG    1       -4.435  -0.722   0.567  0.00  0.00    +0.222 C 
ATOM     17  O   LIG    1       -5.559  -1.142   0.827  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -3.885   0.537   1.165  0.00  0.00    +0.115 C 
ATOM     19  C   LIG    1       -2.805   1.080   0.256  0.00  0.00    +0.126 C 
ENDBRANCH   8  11
BRANCH   7  20
ATOM     20  N   LIG    1        4.801  -1.620  -0.071  0.00  0.00    -0.358 N 
ATOM     21  H   LIG    1        5.442  -1.028  -0.589  0.00  0.00    +0.142 HD
ATOM     22  H   LIG    1        4.936  -2.604  -0.281  0.00  0.00    +0.142 HD
ENDBRANCH   7  20
TORSDOF 2