REMARK  Name = BDB002467
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.863  -0.930   0.244  0.00  0.00    +0.207 C 
ATOM      2  C   LIG    1        0.094   0.269   0.115  0.00  0.00    +0.130 C 
ATOM      3  C   LIG    1       -0.617   1.367  -0.664  0.00  0.00    -0.005 A 
ATOM      4  C   LIG    1       -0.829   2.467   0.175  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1       -1.482   3.601  -0.267  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1       -1.930   3.622  -1.590  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1       -1.718   2.523  -2.439  0.00  0.00    +0.000 A 
ATOM      8  N   LIG    1       -0.285   2.210   1.437  0.00  0.00    -0.273 N 
ATOM      9  C   LIG    1       -0.272   3.159   2.518  0.00  0.00    +0.138 C 
ATOM     10  C   LIG    1       -1.057   1.381  -1.980  0.00  0.00    +0.007 A 
ATOM     11  C   LIG    1        0.339   0.962   1.483  0.00  0.00    +0.236 C 
ATOM     12  O   LIG    1        0.980   0.484   2.408  0.00  0.00    -0.274 OA
ATOM     13  C   LIG    1        1.448  -0.138  -0.416  0.00  0.00    +0.100 A 
ATOM     14  C   LIG    1        2.388   0.891  -0.927  0.00  0.00    +0.345 A 
ATOM     15  O   LIG    1        3.585   0.446  -1.475  0.00  0.00    -0.422 OA
ATOM     16  C   LIG    1        3.976  -0.900  -1.408  0.00  0.00    +0.143 A 
ATOM     17  C   LIG    1        3.147  -1.851  -0.828  0.00  0.00    +0.060 A 
ATOM     18  C   LIG    1        3.597  -3.175  -0.773  0.00  0.00    +0.015 A 
ATOM     19  C   LIG    1        4.851  -3.520  -1.292  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1        5.664  -2.546  -1.871  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1        5.227  -1.225  -1.931  0.00  0.00    +0.047 A 
ATOM     22  O   LIG    1        2.141   2.089  -0.883  0.00  0.00    -0.245 OA
ATOM     23  C   LIG    1        1.845  -1.416  -0.329  0.00  0.00    +0.152 A 
ATOM     24  O   LIG    1        1.085  -2.416   0.302  0.00  0.00    -0.440 OA
ATOM     25  C   LIG    1       -0.179  -2.177   0.703  0.00  0.00    +0.204 C 
ATOM     26  N   LIG    1       -0.786  -3.118   1.342  0.00  0.00    -0.270 NA
ATOM     27  H   LIG    1       -0.110  -3.875   1.503  0.00  0.00    +0.190 HD
ENDROOT
BRANCH   1  28
ATOM     28  C   LIG    1       -2.079  -0.596   1.083  0.00  0.00    +0.321 C 
ATOM     29  O   LIG    1       -2.076  -0.376   2.285  0.00  0.00    -0.250 OA
BRANCH  28  30
ATOM     30  O   LIG    1       -3.185  -0.522   0.284  0.00  0.00    -0.464 OA
BRANCH  30  32
ATOM     31  C   LIG    1       -5.068  -1.421   1.512  0.00  0.00    +0.048 C 
ATOM     32  C   LIG    1       -4.411  -0.177   0.945  0.00  0.00    +0.229 C 
ENDBRANCH  30  32
ENDBRANCH  28  30
ENDBRANCH   1  28
TORSDOF 3