REMARK  Name = LIG000925
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.131   0.833  -0.043  0.00  0.00    +0.073 A 
ATOM      2  C   LIG    1       -1.944   0.123   0.044  0.00  0.00    +0.073 A 
ATOM      3  C   LIG    1       -0.557   0.569  -0.102  0.00  0.00    +0.256 C 
ATOM      4  N   LIG    1        0.235  -0.537   0.050  0.00  0.00    -0.222 N 
ATOM      5  C   LIG    1       -0.505  -1.638   0.380  0.00  0.00    +0.255 C 
ATOM      6  O   LIG    1       -0.126  -2.761   0.652  0.00  0.00    -0.270 OA
ATOM      7  O   LIG    1       -0.222   1.728  -0.270  0.00  0.00    -0.269 OA
ATOM      8  C   LIG    1       -1.907  -1.228   0.353  0.00  0.00    +0.051 A 
ATOM      9  C   LIG    1       -3.052  -1.969   0.574  0.00  0.00    +0.017 A 
ATOM     10  C   LIG    1       -4.270  -1.298   0.458  0.00  0.00    +0.041 A 
ATOM     11  C   LIG    1       -4.299   0.073   0.137  0.00  0.00    +0.145 A 
ATOM     12  F   LIG    1       -5.495   0.670   0.010  0.00  0.00    -0.204 F 
ENDROOT
BRANCH   4  13
ATOM     13  C   LIG    1        1.688  -0.516   0.134  0.00  0.00    +0.171 C 
ATOM     14  C   LIG    1        2.108   0.080   1.482  0.00  0.00    +0.240 C 
ATOM     15  O   LIG    1        1.381   0.109   2.474  0.00  0.00    -0.273 OA
ATOM     16  N   LIG    1        3.404   0.540   1.552  0.00  0.00    -0.255 N 
ATOM     17  H   LIG    1        3.689   0.924   2.443  0.00  0.00    +0.158 HD
ATOM     18  C   LIG    1        4.301   0.690   0.523  0.00  0.00    +0.219 C 
ATOM     19  O   LIG    1        5.404   1.192   0.713  0.00  0.00    -0.275 OA
ATOM     20  C   LIG    1        3.880   0.152  -0.826  0.00  0.00    +0.098 C 
ATOM     21  C   LIG    1        2.372   0.233  -1.007  0.00  0.00    +0.041 C 
ENDBRANCH   4  13
BRANCH   1  22
ATOM     22  N   LIG    1       -3.187   2.152  -0.507  0.00  0.00    -0.355 N 
ATOM     23  H   LIG    1       -4.033   2.651  -0.241  0.00  0.00    +0.142 HD
ATOM     24  H   LIG    1       -2.331   2.688  -0.349  0.00  0.00    +0.142 HD
ENDBRANCH   1  22
TORSDOF 2