REMARK  Name = LIG000600
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.116   0.009  -0.302  0.00  0.00    -0.220 N 
ATOM      2  C   LIG    1        0.689   0.571  -1.258  0.00  0.00    +0.255 C 
ATOM      3  O   LIG    1        0.376   1.029  -2.340  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        2.055   0.519  -0.741  0.00  0.00    +0.049 A 
ATOM      5  C   LIG    1        2.000  -0.040   0.522  0.00  0.00    +0.049 A 
ATOM      6  C   LIG    1        3.133  -0.222   1.291  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        4.352   0.181   0.736  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        4.407   0.750  -0.554  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        3.245   0.927  -1.311  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1        0.600  -0.339   0.811  0.00  0.00    +0.255 C 
ATOM     11  O   LIG    1        0.196  -0.792   1.865  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  17
ATOM     12  O   LIG    1       -5.404   0.050   0.938  0.00  0.00    -0.250 OA
ATOM     13  C   LIG    1       -4.226   0.029   0.589  0.00  0.00    +0.315 C 
ATOM     14  O   LIG    1       -3.422   1.081   0.841  0.00  0.00    -0.392 OA
ATOM     15  C   LIG    1       -2.135   1.156   0.432  0.00  0.00    +0.336 C 
ATOM     16  O   LIG    1       -1.472   2.162   0.684  0.00  0.00    -0.248 OA
ATOM     17  C   LIG    1       -1.570   0.012  -0.396  0.00  0.00    +0.194 C 
ATOM     18  C   LIG    1       -2.206  -1.294   0.026  0.00  0.00    +0.045 C 
ATOM     19  C   LIG    1       -3.691  -1.145  -0.176  0.00  0.00    +0.123 C 
ENDBRANCH   1  17
TORSDOF 1