REMARK  Name = LIG001450
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        3.029   0.386   0.657  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1        2.025  -0.133  -0.114  0.00  0.00    +0.255 C 
ATOM      3  O   LIG    1        2.080  -1.002  -0.962  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1        0.803   0.580   0.253  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        1.142   1.528   1.196  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1        0.205   2.385   1.726  0.00  0.00    +0.015 A 
ATOM      7  C   LIG    1       -1.113   2.244   1.272  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1       -1.490   1.254   0.325  0.00  0.00    +0.028 A 
ATOM      9  C   LIG    1       -0.492   0.430  -0.213  0.00  0.00    +0.036 A 
ATOM     10  C   LIG    1        2.578   1.417   1.437  0.00  0.00    +0.254 C 
ATOM     11  O   LIG    1        3.204   2.126   2.202  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1        7.815  -1.372  -1.382  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1        6.805  -0.967  -0.814  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1        6.159   0.167  -1.241  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        6.531   0.599  -2.076  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        4.989   0.707  -0.756  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1        4.479   1.682  -1.304  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1        4.440   0.061   0.521  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1        4.743  -1.435   0.527  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1        6.246  -1.641   0.418  0.00  0.00    +0.098 C 
ENDBRANCH   1  18
BRANCH   8  21
ATOM     21  N   LIG    1       -2.814   1.244  -0.111  0.00  0.00    -0.341 N 
ATOM     22  H   LIG    1       -3.458   1.644   0.568  0.00  0.00    +0.146 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -3.395   0.128  -0.866  0.00  0.00    +0.070 C 
ATOM     24  C   LIG    1       -3.598  -1.087   0.060  0.00  0.00    +0.022 C 
ATOM     25  C   LIG    1       -4.779  -1.945  -0.376  0.00  0.00    +0.002 C 
ATOM     26  C   LIG    1       -6.092  -1.163  -0.334  0.00  0.00    +0.000 C 
ATOM     27  C   LIG    1       -5.921   0.331  -0.614  0.00  0.00    +0.002 C 
ATOM     28  C   LIG    1       -4.715   0.606  -1.506  0.00  0.00    +0.022 C 
ENDBRANCH  21  23
ENDBRANCH   8  21
TORSDOF 3