REMARK  Name = LIG001418
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.447   0.146   0.540  0.00  0.00    -0.300 N 
ATOM      2  H   LIG    1       -0.172   0.711  -0.258  0.00  0.00    +0.150 HD
ATOM      3  C   LIG    1        0.490  -0.729   1.049  0.00  0.00    +0.248 C 
ATOM      4  O   LIG    1        0.197  -1.623   1.837  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  11
ATOM      5  O   LIG    1       -5.757   0.128  -0.660  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1       -4.629  -0.001  -0.194  0.00  0.00    +0.219 C 
ATOM      7  N   LIG    1       -3.747  -0.910  -0.720  0.00  0.00    -0.255 N 
ATOM      8  H   LIG    1       -4.072  -1.367  -1.562  0.00  0.00    +0.158 HD
ATOM      9  C   LIG    1       -2.379  -0.855  -0.588  0.00  0.00    +0.240 C 
ATOM     10  O   LIG    1       -1.645  -1.343  -1.446  0.00  0.00    -0.273 OA
ATOM     11  C   LIG    1       -1.869  -0.140   0.672  0.00  0.00    +0.160 C 
ATOM     12  C   LIG    1       -2.668   1.143   0.861  0.00  0.00    +0.041 C 
ATOM     13  C   LIG    1       -4.145   0.804   0.990  0.00  0.00    +0.098 C 
ENDBRANCH   1  11
BRANCH   3  14
ATOM     14  C   LIG    1        1.905  -0.568   0.609  0.00  0.00    +0.074 A 
ATOM     15  C   LIG    1        2.324   0.451  -0.249  0.00  0.00    +0.166 A 
ATOM     16  F   LIG    1        1.444   1.359  -0.699  0.00  0.00    -0.202 F 
ATOM     17  C   LIG    1        3.667   0.534  -0.615  0.00  0.00    +0.162 A 
ATOM     18  C   LIG    1        4.616  -0.375  -0.132  0.00  0.00    +0.036 A 
ATOM     19  C   LIG    1        4.202  -1.392   0.725  0.00  0.00    +0.003 A 
ATOM     20  C   LIG    1        2.855  -1.488   1.091  0.00  0.00    +0.016 A 
BRANCH  17  21
ATOM     21  N   LIG    1        4.095   1.590  -1.511  0.00  0.00    +0.059 N 
ATOM     22  O   LIG    1        5.180   2.133  -1.261  0.00  0.00    -0.126 OA
ATOM     23  O   LIG    1        3.368   1.861  -2.474  0.00  0.00    -0.126 OA
ENDBRANCH  17  21
ENDBRANCH   3  14
TORSDOF 3