REMARK  Name = LIG001746
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        3.347  -0.675  -0.040  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1        3.395  -1.878  -0.729  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1        4.361  -2.432  -1.218  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        2.021  -2.386  -0.794  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1        1.179  -1.435  -0.222  0.00  0.00    -0.003 A 
ATOM      6  C   LIG    1       -0.184  -1.665  -0.163  0.00  0.00    +0.030 A 
ATOM      7  C   LIG    1       -0.678  -2.869  -0.684  0.00  0.00    +0.017 A 
ATOM      8  C   LIG    1        0.188  -3.819  -1.260  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1        1.561  -3.579  -1.321  0.00  0.00    +0.013 A 
ATOM     10  C   LIG    1        1.976  -0.258   0.226  0.00  0.00    +0.146 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1        8.056   2.037  -0.949  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        7.017   1.445  -0.672  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1        5.932   1.491  -1.511  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1        6.058   2.009  -2.370  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1        4.663   1.010  -1.280  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1        3.749   1.270  -2.062  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1        4.457   0.268   0.049  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1        5.766  -0.365   0.520  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1        6.832   0.713   0.637  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   6  20
ATOM     20  C   LIG    1       -1.075  -0.704   0.406  0.00  0.00    -0.065 C 
ATOM     21  C   LIG    1       -1.825   0.107   0.878  0.00  0.00    -0.082 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -2.750   1.094   1.450  0.00  0.00    +0.171 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.096   2.142   0.490  0.00  0.00    -0.302 NA
ATOM     24  H   LIG    1       -2.236   2.507   0.086  0.00  0.00    +0.123 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -3.963   1.677  -0.597  0.00  0.00    +0.117 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -5.351   1.288  -0.143  0.00  0.00    -0.034 A 
ATOM     27  C   LIG    1       -5.826  -0.016  -0.341  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -7.112  -0.372   0.073  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -7.934   0.572   0.687  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -7.473   1.871   0.889  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -6.188   2.228   0.475  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH   6  20
TORSDOF 6