REMARK  Name = LIG001036
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.125   1.213  -1.223  0.00  0.00    -0.271 OA
ATOM      2  C   LIG    1        0.879   0.481  -0.274  0.00  0.00    +0.238 C 
ATOM      3  N   LIG    1        1.846  -0.061   0.533  0.00  0.00    -0.300 N 
ATOM      4  H   LIG    1        1.579  -0.502   1.408  0.00  0.00    +0.150 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        3.231   0.352   0.399  0.00  0.00    +0.168 C 
ATOM      6  C   LIG    1        4.097  -0.325   1.444  0.00  0.00    +0.240 C 
ATOM      7  O   LIG    1        3.765  -0.587   2.590  0.00  0.00    -0.273 OA
ATOM      8  N   LIG    1        5.295  -0.609   0.879  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1        6.042  -1.077   1.367  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1        5.249  -0.547  -0.475  0.00  0.00    +0.221 C 
ATOM     11  O   LIG    1        6.148  -0.904  -1.219  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        3.900  -0.050  -0.911  0.00  0.00    +0.128 C 
ENDBRANCH   3   5
BRANCH   2  13
ATOM     13  C   LIG    1       -0.496   0.099   0.126  0.00  0.00    +0.068 C 
ATOM     14  C   LIG    1       -1.545   0.593  -0.549  0.00  0.00    +0.013 C 
BRANCH  14  15
ATOM     15  C   LIG    1       -2.944   0.288  -0.225  0.00  0.00    -0.025 A 
ATOM     16  C   LIG    1       -3.363  -0.993   0.158  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1       -4.709  -1.248   0.434  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1       -5.651  -0.227   0.320  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -5.249   1.047  -0.076  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -3.903   1.301  -0.353  0.00  0.00    +0.008 A 
ENDBRANCH  14  15
ENDBRANCH   2  13
TORSDOF 3