REMARK  Name = LIG000766
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.041   2.298   0.594  0.00  0.00    -0.280 N 
ATOM      2  C   LIG    1       -2.445   1.080   0.323  0.00  0.00    +0.172 A 
ATOM      3  C   LIG    1       -1.087   1.333   0.312  0.00  0.00    +0.148 A 
ATOM      4  C   LIG    1       -0.246   0.242   0.053  0.00  0.00    +0.152 A 
ATOM      5  N   LIG    1       -0.830  -0.963  -0.169  0.00  0.00    -0.197 NA
ATOM      6  C   LIG    1       -2.172  -1.111  -0.128  0.00  0.00    +0.222 A 
ATOM      7  N   LIG    1       -0.820   2.662   0.552  0.00  0.00    -0.230 NA
ATOM      8  N   LIG    1       -3.035  -0.108   0.111  0.00  0.00    -0.194 NA
ATOM      9  C   LIG    1       -2.007   3.205   0.721  0.00  0.00    +0.206 A 
ENDROOT
BRANCH   1  14
ATOM     10  C   LIG    1       -7.403   4.530   1.255  0.00  0.00    +0.172 C 
ATOM     11  N   LIG    1       -6.355   3.569   1.010  0.00  0.00    -0.272 N 
ATOM     12  N   LIG    1       -6.678   2.286   0.768  0.00  0.00    -0.178 NA
ATOM     13  C   LIG    1       -5.497   1.686   0.590  0.00  0.00    +0.160 A 
ATOM     14  C   LIG    1       -4.422   2.586   0.718  0.00  0.00    +0.087 A 
ATOM     15  C   LIG    1       -5.009   3.803   0.991  0.00  0.00    +0.134 A 
ENDBRANCH   1  14
BRANCH   6  16
ATOM     16  N   LIG    1       -2.695  -2.365  -0.383  0.00  0.00    -0.295 N 
ATOM     17  C   LIG    1       -4.121  -2.571  -0.119  0.00  0.00    +0.136 C 
ATOM     18  C   LIG    1       -4.501  -4.023  -0.448  0.00  0.00    +0.179 C 
ATOM     19  O   LIG    1       -3.779  -4.997   0.321  0.00  0.00    -0.377 OA
ATOM     20  C   LIG    1       -2.479  -4.548   0.738  0.00  0.00    +0.179 C 
ATOM     21  C   LIG    1       -1.830  -3.540  -0.225  0.00  0.00    +0.136 C 
ENDBRANCH   6  16
BRANCH   4  22
ATOM     22  N   LIG    1        1.146   0.379   0.033  0.00  0.00    -0.323 N 
ATOM     23  H   LIG    1        1.399   1.361  -0.060  0.00  0.00    +0.148 HD
BRANCH  22  24
ATOM     24  C   LIG    1        1.824  -0.512  -0.888  0.00  0.00    +0.138 C 
BRANCH  24  25
ATOM     25  C   LIG    1        3.296  -0.167  -0.919  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        3.875   0.414  -2.052  0.00  0.00    +0.009 A 
ATOM     27  C   LIG    1        5.235   0.734  -2.062  0.00  0.00    +0.046 A 
ATOM     28  C   LIG    1        6.038   0.488  -0.946  0.00  0.00    +0.121 A 
ATOM     29  C   LIG    1        5.466  -0.088   0.187  0.00  0.00    +0.046 A 
ATOM     30  C   LIG    1        4.104  -0.410   0.200  0.00  0.00    +0.009 A 
BRANCH  28  31
ATOM     31  O   LIG    1        7.348   0.846  -1.103  0.00  0.00    -0.490 OA
BRANCH  31  32
ATOM     32  C   LIG    1        8.233   0.740   0.018  0.00  0.00    +0.256 C 
BRANCH  32  33
ATOM     33  C   LIG    1        8.856  -0.654   0.071  0.00  0.00    +0.196 C 
BRANCH  33  34
ATOM     34  O   LIG    1        9.604  -0.905  -1.118  0.00  0.00    -0.392 OA
ATOM     35  H   LIG    1        9.011  -0.683  -1.861  0.00  0.00    +0.210 HD
ENDBRANCH  33  34
ENDBRANCH  32  33
ENDBRANCH  31  32
ENDBRANCH  28  31
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH   4  22
TORSDOF 9