REMARK  Name = LIG000632
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.050   0.449  -0.058  0.00  0.00    +0.230 C 
ATOM      2  N   LIG    1       -0.058  -0.368  -0.017  0.00  0.00    -0.302 N 
ATOM      3  H   LIG    1        0.080  -1.374   0.041  0.00  0.00    +0.150 HD
ATOM      4  O   LIG    1        0.977   1.660   0.139  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.337   0.146   0.438  0.00  0.00    +0.168 C 
ATOM      6  C   LIG    1       -2.370  -0.963   0.498  0.00  0.00    +0.240 C 
ATOM      7  O   LIG    1       -2.157  -2.120   0.824  0.00  0.00    -0.273 OA
ATOM      8  N   LIG    1       -3.562  -0.451   0.107  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1       -4.407  -0.997   0.046  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1       -3.423   0.736  -0.533  0.00  0.00    +0.221 C 
ATOM     11  O   LIG    1       -4.323   1.325  -1.110  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -1.986   1.169  -0.489  0.00  0.00    +0.128 C 
ENDBRANCH   2   5
BRANCH   1  14
ATOM     13  C   LIG    1        2.818  -1.162   0.756  0.00  0.00    +0.033 C 
ATOM     14  C   LIG    1        2.374  -0.271  -0.397  0.00  0.00    +0.135 C 
BRANCH  14  15
ATOM     15  N   LIG    1        3.426   0.723  -0.684  0.00  0.00    -0.320 NA
ATOM     16  H   LIG    1        3.499   1.342   0.128  0.00  0.00    +0.119 HD
ATOM     17  H   LIG    1        3.080   1.342  -1.421  0.00  0.00    +0.119 HD
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 3