REMARK  Name = LIG000250
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.648  -0.194   0.275  0.00  0.00    +0.121 A 
ATOM      2  C   LIG    1        0.351  -0.454  -0.676  0.00  0.00    +0.051 A 
ATOM      3  C   LIG    1        1.660  -0.113  -0.381  0.00  0.00    -0.015 A 
ATOM      4  C   LIG    1        2.900  -0.294  -1.187  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1        3.916   0.336  -0.355  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        3.414   0.718   0.877  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1        4.018   1.142   1.841  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        1.968   0.477   0.839  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1        1.012   0.746   1.798  0.00  0.00    +0.017 A 
ATOM     10  C   LIG    1       -0.314   0.407   1.503  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        5.329   0.265  -0.710  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        6.027  -0.820   0.110  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        5.703  -2.006   0.039  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        7.008  -0.415   0.978  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        7.445  -1.147   1.521  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        7.383   0.861   1.308  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1        8.256   1.055   2.151  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        6.668   1.996   0.620  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        6.076   1.597  -0.719  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  O   LIG    1       -1.901  -0.564  -0.128  0.00  0.00    -0.488 OA
BRANCH  20  26
ATOM     21  N   LIG    1       -5.124  -1.069  -0.509  0.00  0.00    -0.299 NA
ATOM     22  C   LIG    1       -4.618  -0.031  -1.412  0.00  0.00    +0.088 C 
ATOM     23  C   LIG    1       -4.269   1.237  -0.611  0.00  0.00    +0.003 C 
ATOM     24  C   LIG    1       -3.397   2.170  -1.453  0.00  0.00    +0.009 C 
ATOM     25  C   LIG    1       -3.620   0.922   0.753  0.00  0.00    +0.050 C 
ATOM     26  C   LIG    1       -2.997  -0.475   0.796  0.00  0.00    +0.188 C 
ATOM     27  C   LIG    1       -4.048  -1.546   0.391  0.00  0.00    +0.129 C 
BRANCH  21  29
ATOM     28  C   LIG    1       -6.454  -3.175  -0.362  0.00  0.00    +0.020 C 
ATOM     29  C   LIG    1       -5.745  -2.168  -1.262  0.00  0.00    +0.081 C 
ENDBRANCH  21  29
ENDBRANCH  20  26
ENDBRANCH   1  20
TORSDOF 4