REMARK  Name = LIG000135
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        3.535  -0.042   0.218  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1        2.677   1.012  -0.064  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1        2.939   2.083  -0.575  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        1.335   0.590   0.352  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1        1.411  -0.732   0.784  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1        0.275  -1.392   1.222  0.00  0.00    +0.028 A 
ATOM      7  C   LIG    1       -0.946  -0.696   1.234  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1       -0.995   0.641   0.783  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1        0.153   1.300   0.336  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1        2.811  -1.228   0.654  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1        8.233   0.752  -2.549  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        7.226   0.570  -1.870  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1        6.112  -0.027  -2.405  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1        6.169  -0.272  -3.384  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1        4.979  -0.447  -1.746  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1        4.141  -1.133  -2.329  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1        4.915  -0.124  -0.245  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1        5.748   1.118   0.074  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1        7.178   0.899  -0.397  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1       -2.136  -1.353   1.615  0.00  0.00    -0.340 N 
ATOM     21  H   LIG    1       -1.907  -2.111   2.255  0.00  0.00    +0.146 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -2.898  -1.904   0.483  0.00  0.00    +0.137 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.737  -0.870  -0.240  0.00  0.00    -0.023 A 
ATOM     24  C   LIG    1       -4.880  -0.258   0.349  0.00  0.00    -0.013 A 
ATOM     25  C   LIG    1       -5.622   0.681  -0.413  0.00  0.00    -0.018 A 
ATOM     26  C   LIG    1       -6.758   1.296   0.139  0.00  0.00    +0.008 A 
ATOM     27  C   LIG    1       -7.175   1.004   1.436  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -6.458   0.094   2.199  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -5.220   0.998  -1.718  0.00  0.00    +0.008 A 
ATOM     30  C   LIG    1       -4.096   0.404  -2.284  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1       -5.327  -0.527   1.664  0.00  0.00    +0.009 A 
ATOM     32  C   LIG    1       -3.363  -0.523  -1.553  0.00  0.00    +0.006 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   7  20
TORSDOF 4