REMARK  Name = LIG000565
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.405   1.933  -1.022  0.00  0.00    -0.029 A 
ATOM      2  C   LIG    1       -1.592   1.766  -0.297  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -2.608   0.946  -0.804  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1       -2.478   0.280  -2.011  0.00  0.00    +0.100 A 
ATOM      5  N   LIG    1       -3.481  -0.544  -2.534  0.00  0.00    -0.131 NA
ATOM      6  N   LIG    1       -4.565  -0.668  -1.926  0.00  0.00    -0.061 NA
ATOM      7  N   LIG    1       -4.799  -0.038  -0.736  0.00  0.00    -0.198 N 
ATOM      8  C   LIG    1       -1.286   0.436  -2.726  0.00  0.00    +0.031 A 
ATOM      9  C   LIG    1       -3.863   0.747  -0.088  0.00  0.00    +0.278 A 
ATOM     10  O   LIG    1       -4.030   1.264   1.013  0.00  0.00    -0.265 OA
ATOM     11  C   LIG    1       -0.258   1.250  -2.237  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   7  12
ATOM     12  C   LIG    1       -6.104  -0.296  -0.130  0.00  0.00    +0.199 C 
ATOM     13  C   LIG    1       -6.892   1.010   0.021  0.00  0.00    +0.244 C 
ATOM     14  O   LIG    1       -6.778   1.971  -0.738  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -7.843   1.028   1.018  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -8.366   1.889   1.111  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -8.171   0.025   1.894  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -9.070   0.168   2.717  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -7.426  -1.280   1.736  0.00  0.00    +0.099 C 
ATOM     20  C   LIG    1       -6.024  -1.054   1.195  0.00  0.00    +0.046 C 
ENDBRANCH   7  12
BRANCH   1  21
ATOM     21  C   LIG    1        0.709   2.797  -0.488  0.00  0.00    +0.141 C 
BRANCH  21  25
ATOM     22  N   LIG    1        3.480   0.731   0.625  0.00  0.00    -0.269 N 
ATOM     23  H   LIG    1        3.216   0.874   1.587  0.00  0.00    +0.156 HD
ATOM     24  C   LIG    1        2.765   1.465  -0.297  0.00  0.00    +0.304 C 
ATOM     25  N   LIG    1        1.646   2.020   0.293  0.00  0.00    -0.295 N 
ATOM     26  H   LIG    1        1.256   1.508   1.068  0.00  0.00    +0.151 HD
ATOM     27  O   LIG    1        3.048   1.645  -1.473  0.00  0.00    -0.252 OA
BRANCH  22  33
ATOM     28  C   LIG    1        8.200  -2.457  -0.068  0.00  0.00    +0.044 C 
ATOM     29  C   LIG    1        6.962  -1.624   0.124  0.00  0.00    -0.047 A 
ATOM     30  C   LIG    1        6.429  -1.377   1.403  0.00  0.00    -0.046 A 
ATOM     31  C   LIG    1        7.082  -1.925   2.643  0.00  0.00    +0.044 C 
ATOM     32  C   LIG    1        5.273  -0.585   1.525  0.00  0.00    +0.027 A 
ATOM     33  C   LIG    1        4.637  -0.042   0.401  0.00  0.00    +0.035 A 
ATOM     34  C   LIG    1        5.164  -0.304  -0.861  0.00  0.00    +0.023 A 
ATOM     35  C   LIG    1        6.316  -1.085  -0.997  0.00  0.00    +0.005 A 
ENDBRANCH  22  33
ENDBRANCH  21  25
ENDBRANCH   1  21
TORSDOF 4