REMARK  Name = LIG000730
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.058   0.386  -0.347  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -0.182   0.303  -1.420  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -0.438   0.406  -2.604  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        1.155   0.064  -0.863  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1        1.028  -0.061   0.529  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1        2.137  -0.302   1.324  0.00  0.00    +0.011 A 
ATOM      7  C   LIG    1        3.357  -0.397   0.667  0.00  0.00    -0.029 A 
ATOM      8  C   LIG    1        4.711  -0.677   1.233  0.00  0.00    +0.117 C 
ATOM      9  N   LIG    1        5.669  -0.378   0.140  0.00  0.00    -0.308 NA
ATOM     10  H   LIG    1        5.937   0.600   0.247  0.00  0.00    +0.123 HD
ATOM     11  C   LIG    1        4.894  -0.464  -1.124  0.00  0.00    +0.117 C 
ATOM     12  C   LIG    1        3.467  -0.271  -0.729  0.00  0.00    -0.028 A 
ATOM     13  C   LIG    1        2.362  -0.042  -1.531  0.00  0.00    +0.018 A 
ATOM     14  C   LIG    1       -0.407   0.076   0.920  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  21
ATOM     15  O   LIG    1       -6.411  -0.326   0.572  0.00  0.00    -0.275 OA
ATOM     16  C   LIG    1       -5.280  -0.087   0.159  0.00  0.00    +0.219 C 
ATOM     17  N   LIG    1       -4.472  -1.089  -0.315  0.00  0.00    -0.255 N 
ATOM     18  H   LIG    1       -4.854  -2.020  -0.211  0.00  0.00    +0.158 HD
ATOM     19  C   LIG    1       -3.099  -1.038  -0.401  0.00  0.00    +0.240 C 
ATOM     20  O   LIG    1       -2.438  -2.072  -0.360  0.00  0.00    -0.273 OA
ATOM     21  C   LIG    1       -2.504   0.374  -0.531  0.00  0.00    +0.163 C 
ATOM     22  C   LIG    1       -3.222   1.307   0.439  0.00  0.00    +0.041 C 
ATOM     23  C   LIG    1       -4.711   1.312   0.126  0.00  0.00    +0.098 C 
ENDBRANCH   1  21
TORSDOF 1