REMARK  Name = BDB065298
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.110   0.649   0.052  0.00  0.00    +0.351 C 
ATOM      2  O   LIG    1        0.130   0.973   1.208  0.00  0.00    -0.244 OA
ENDROOT
BRANCH   1   9
ATOM      3  C   LIG    1       -6.192  -0.301   0.277  0.00  0.00    +0.162 A 
ATOM      4  C   LIG    1       -6.465  -0.006  -1.079  0.00  0.00    +0.165 A 
ATOM      5  C   LIG    1       -5.420   0.360  -1.931  0.00  0.00    +0.096 A 
ATOM      6  C   LIG    1       -4.124   0.431  -1.425  0.00  0.00    +0.143 A 
ATOM      7  C   LIG    1       -3.835   0.150  -0.098  0.00  0.00    +0.022 A 
ATOM      8  C   LIG    1       -2.455   0.240   0.354  0.00  0.00    +0.034 A 
ATOM      9  C   LIG    1       -1.480   0.587  -0.502  0.00  0.00    +0.144 A 
ATOM     10  C   LIG    1       -1.769   0.901  -1.917  0.00  0.00    +0.351 A 
ATOM     11  O   LIG    1       -0.906   1.252  -2.711  0.00  0.00    -0.244 OA
ATOM     12  O   LIG    1       -3.100   0.790  -2.320  0.00  0.00    -0.421 OA
ATOM     13  C   LIG    1       -4.877  -0.217   0.759  0.00  0.00    +0.061 A 
BRANCH   3  15
ATOM     14  C   LIG    1       -7.065  -0.879   2.430  0.00  0.00    +0.277 C 
ATOM     15  O   LIG    1       -7.273  -0.666   1.040  0.00  0.00    -0.491 OA
ENDBRANCH   3  15
BRANCH   4  16
ATOM     16  O   LIG    1       -7.778  -0.109  -1.466  0.00  0.00    -0.491 OA
ATOM     17  C   LIG    1       -8.098   0.260  -2.802  0.00  0.00    +0.277 C 
ENDBRANCH   4  16
ENDBRANCH   1   9
BRANCH   1  18
ATOM     18  O   LIG    1        0.800   0.221  -0.903  0.00  0.00    -0.422 OA
BRANCH  18  19
ATOM     19  C   LIG    1        2.188   0.198  -0.653  0.00  0.00    +0.133 A 
ATOM     20  C   LIG    1        2.744  -0.145   0.581  0.00  0.00    +0.055 A 
ATOM     21  C   LIG    1        4.141  -0.167   0.737  0.00  0.00    -0.014 A 
ATOM     22  C   LIG    1        4.973   0.135  -0.371  0.00  0.00    -0.017 A 
ATOM     23  C   LIG    1        6.369   0.113  -0.211  0.00  0.00    +0.019 A 
ATOM     24  C   LIG    1        6.944  -0.201   1.028  0.00  0.00    +0.015 A 
ATOM     25  C   LIG    1        6.119  -0.485   2.123  0.00  0.00    +0.012 A 
ATOM     26  C   LIG    1        4.387   0.451  -1.607  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1        4.728  -0.474   1.975  0.00  0.00    +0.009 A 
ATOM     28  C   LIG    1        2.999   0.477  -1.751  0.00  0.00    +0.047 A 
BRANCH  24  29
ATOM     29  C   LIG    1        8.433  -0.209   1.169  0.00  0.00    +0.116 C 
ATOM     30  N   LIG    1        9.163   0.399   0.286  0.00  0.00    -0.285 NA
ATOM     31  H   LIG    1       10.149   0.335   0.545  0.00  0.00    +0.188 HD
BRANCH  29  32
ATOM     32  N   LIG    1        9.028  -0.858   2.217  0.00  0.00    -0.343 N 
ATOM     33  H   LIG    1        8.526  -1.669   2.568  0.00  0.00    +0.144 HD
ATOM     34  H   LIG    1       10.013  -1.070   2.089  0.00  0.00    +0.144 HD
ENDBRANCH  29  32
ENDBRANCH  24  29
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 7