REMARK  Name = BDB000582
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.256  -0.629   0.276  0.00  0.00    -0.038 C 
ATOM      2  C   LIG    1       -0.003   0.032  -0.058  0.00  0.00    +0.012 C 
ATOM      3  C   LIG    1       -1.200  -0.178   0.525  0.00  0.00    +0.009 C 
ATOM      4  C   LIG    1       -1.239  -1.194   1.630  0.00  0.00    +0.229 C 
ATOM      5  O   LIG    1       -2.264  -1.473   2.237  0.00  0.00    -0.284 OA
ATOM      6  C   LIG    1        0.056  -1.899   2.003  0.00  0.00    +0.226 C 
ATOM      7  O   LIG    1        0.097  -2.737   2.893  0.00  0.00    -0.284 OA
ATOM      8  C   LIG    1        1.277  -1.546   1.257  0.00  0.00    +0.059 C 
ENDROOT
BRANCH   1  10
ATOM      9  C   LIG    1        2.810   1.280  -0.354  0.00  0.00    +0.015 C 
ATOM     10  C   LIG    1        2.516  -0.225  -0.535  0.00  0.00    -0.013 C 
ATOM     11  C   LIG    1        3.795  -0.984  -0.101  0.00  0.00    +0.015 C 
ATOM     12  C   LIG    1        2.307  -0.530  -2.035  0.00  0.00    +0.015 C 
ENDBRANCH   1  10
BRANCH   3  13
ATOM     13  C   LIG    1       -2.509   0.541   0.142  0.00  0.00    -0.009 C 
ATOM     14  C   LIG    1       -3.565  -0.475  -0.342  0.00  0.00    +0.015 C 
ATOM     15  C   LIG    1       -3.062   1.339   1.343  0.00  0.00    +0.015 C 
ATOM     16  C   LIG    1       -2.325   1.562  -1.012  0.00  0.00    +0.015 C 
ENDBRANCH   3  13
TORSDOF 2