REMARK  Name = LIG001129
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -4.240   1.746   0.015  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -3.248   1.033   0.138  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1       -2.978   0.399   1.324  0.00  0.00    -0.253 N 
ATOM      4  H   LIG    1       -3.679   0.505   2.043  0.00  0.00    +0.158 HD
ATOM      5  C   LIG    1       -2.056  -0.600   1.534  0.00  0.00    +0.260 C 
ATOM      6  O   LIG    1       -2.119  -1.308   2.537  0.00  0.00    -0.271 OA
ATOM      7  C   LIG    1       -0.981  -0.771   0.464  0.00  0.00    +0.259 C 
ATOM      8  C   LIG    1       -1.621  -0.557  -0.906  0.00  0.00    +0.063 C 
ATOM      9  C   LIG    1       -2.261   0.824  -0.984  0.00  0.00    +0.100 C 
ENDROOT
BRANCH   7  10
ATOM     10  O   LIG    1        0.002   0.226   0.739  0.00  0.00    -0.480 OA
BRANCH  10  11
ATOM     11  C   LIG    1        1.280   0.039   0.294  0.00  0.00    +0.122 A 
ATOM     12  C   LIG    1        2.166   1.063   0.641  0.00  0.00    +0.045 A 
ATOM     13  C   LIG    1        3.505   1.013   0.251  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        3.969  -0.068  -0.493  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1        3.093  -1.094  -0.844  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        1.751  -1.042  -0.452  0.00  0.00    +0.045 A 
ENDBRANCH  10  11
ENDBRANCH   7  10
TORSDOF 2