REMARK  Name = LIG000037
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        3.337   0.502  -0.487  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1        2.430  -0.351   0.079  0.00  0.00    +0.255 C 
ATOM      3  O   LIG    1        2.615  -1.411   0.645  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        1.115   0.260  -0.093  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        1.299   1.475  -0.720  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1        0.237   2.301  -1.017  0.00  0.00    +0.015 A 
ATOM      7  C   LIG    1       -1.045   1.858  -0.658  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1       -1.242   0.616  -0.012  0.00  0.00    +0.034 A 
ATOM      9  C   LIG    1       -0.137  -0.198   0.277  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1        2.732   1.640  -0.949  0.00  0.00    +0.254 C 
ATOM     11  O   LIG    1        3.240   2.619  -1.461  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1        8.347  -1.085   1.099  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1        7.289  -0.668   0.637  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1        6.501   0.204   1.347  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        6.816   0.420   2.283  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        5.251   0.674   1.012  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1        4.604   1.349   1.811  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1        4.783   0.354  -0.412  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1        5.296  -1.018  -0.837  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1        6.815  -1.032  -0.751  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   8  21
ATOM     21  N   LIG    1       -2.507   0.126   0.374  0.00  0.00    -0.285 N 
ATOM     22  H   LIG    1       -2.512  -0.773   0.841  0.00  0.00    +0.155 HD
ATOM     23  C   LIG    1       -3.743   0.733   0.199  0.00  0.00    +0.220 C 
ATOM     24  O   LIG    1       -3.940   1.827  -0.315  0.00  0.00    -0.275 OA
BRANCH  23  25
ATOM     25  C   LIG    1       -4.881  -0.117   0.765  0.00  0.00    +0.075 C 
ATOM     26  C   LIG    1       -5.013  -1.478   0.058  0.00  0.00    +0.013 C 
ATOM     27  C   LIG    1       -6.457  -1.570  -0.425  0.00  0.00    +0.001 C 
ATOM     28  C   LIG    1       -7.219  -0.627   0.488  0.00  0.00    +0.001 C 
ATOM     29  C   LIG    1       -6.260   0.542   0.637  0.00  0.00    +0.013 C 
ENDBRANCH  23  25
ENDBRANCH   8  21
TORSDOF 3