REMARK  Name = LIG001544
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.584  -0.393  -0.764  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.344  -1.115  -1.921  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.953  -2.082  -2.335  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -2.161  -0.523  -2.553  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -1.694   0.508  -1.735  0.00  0.00    -0.013 A 
ATOM      6  C   LIG    1       -0.565   1.236  -2.097  0.00  0.00    -0.025 A 
ATOM      7  C   LIG    1        0.077   0.873  -3.297  0.00  0.00    +0.005 A 
ATOM      8  C   LIG    1       -0.407  -0.172  -4.107  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -1.544  -0.886  -3.735  0.00  0.00    +0.013 A 
ATOM     10  C   LIG    1       -2.578   0.634  -0.534  0.00  0.00    +0.145 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -6.070  -1.474   4.024  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -5.681  -1.319   2.871  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -5.817  -0.111   2.236  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -6.188   0.632   2.812  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -5.148   0.302   1.106  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -5.065   1.500   0.847  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -4.564  -0.820   0.231  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -3.979  -1.906   1.137  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -5.057  -2.435   2.069  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   6  20
ATOM     20  C   LIG    1       -0.007   2.342  -1.243  0.00  0.00    +0.140 C 
BRANCH  20  21
ATOM     21  N   LIG    1        1.032   1.842  -0.369  0.00  0.00    -0.307 N 
ATOM     22  H   LIG    1        0.756   1.165   0.328  0.00  0.00    +0.149 HD
ATOM     23  C   LIG    1        2.364   1.941  -0.720  0.00  0.00    +0.246 C 
ATOM     24  O   LIG    1        2.760   2.509  -1.731  0.00  0.00    -0.270 OA
BRANCH  23  25
ATOM     25  C   LIG    1        3.337   1.278   0.177  0.00  0.00    +0.055 A 
ATOM     26  C   LIG    1        4.543   0.805  -0.338  0.00  0.00    +0.024 A 
ATOM     27  C   LIG    1        5.464   0.176   0.510  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1        5.134   0.050   1.878  0.00  0.00    +0.071 A 
ATOM     29  C   LIG    1        6.044  -0.578   2.717  0.00  0.00    +0.028 A 
ATOM     30  C   LIG    1        7.260  -1.077   2.241  0.00  0.00    +0.002 A 
ATOM     31  C   LIG    1        7.582  -0.949   0.894  0.00  0.00    +0.001 A 
ATOM     32  N   LIG    1        3.977   0.518   2.384  0.00  0.00    -0.254 NA
ATOM     33  C   LIG    1        6.687  -0.323   0.029  0.00  0.00    +0.010 A 
ATOM     34  C   LIG    1        3.115   1.129   1.535  0.00  0.00    +0.124 A 
ENDBRANCH  23  25
ENDBRANCH  20  21
ENDBRANCH   6  20
TORSDOF 4