REMARK  Name = LIG000011
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.075  -0.430  -0.681  0.00  0.00    -0.198 N 
ATOM      2  C   LIG    1        0.596   0.157   0.376  0.00  0.00    +0.278 A 
ATOM      3  O   LIG    1        0.053   0.786   1.280  0.00  0.00    -0.265 OA
ATOM      4  C   LIG    1        2.045  -0.012   0.370  0.00  0.00    +0.068 A 
ATOM      5  C   LIG    1        2.578  -0.705  -0.705  0.00  0.00    +0.100 A 
ATOM      6  C   LIG    1        3.964  -0.892  -0.752  0.00  0.00    +0.030 A 
ATOM      7  C   LIG    1        4.789  -0.392   0.262  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        4.233   0.302   1.335  0.00  0.00    +0.001 A 
ATOM      9  N   LIG    1        1.791  -1.215  -1.743  0.00  0.00    -0.131 NA
ATOM     10  C   LIG    1        2.854   0.495   1.393  0.00  0.00    +0.015 A 
ATOM     11  N   LIG    1        0.550  -1.079  -1.709  0.00  0.00    -0.061 NA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1       -5.343   0.638   0.486  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -4.195   0.393   0.127  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1       -3.458  -0.594   0.731  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -3.907  -1.078   1.496  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -2.203  -1.048   0.390  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1       -1.728  -2.031   0.956  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1       -1.530  -0.332  -0.786  0.00  0.00    +0.199 C 
ATOM     19  C   LIG    1       -2.038   1.102  -0.929  0.00  0.00    +0.046 C 
ATOM     20  C   LIG    1       -3.553   1.093  -1.049  0.00  0.00    +0.099 C 
ENDBRANCH   1  18
TORSDOF 1