REMARK  Name = BDB055832
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.785  -0.894   0.274  0.00  0.00    -0.009 A 
ATOM      2  C   LIG    1        0.582  -0.653   0.451  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1        1.052   0.635   0.748  0.00  0.00    -0.011 A 
ATOM      4  C   LIG    1        0.121   1.674   0.888  0.00  0.00    +0.052 A 
ATOM      5  C   LIG    1       -1.248   1.444   0.724  0.00  0.00    +0.122 A 
ATOM      6  C   LIG    1       -1.698   0.161   0.414  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1       -3.017  -2.788   1.798  0.00  0.00    +0.070 C 
ATOM      8  C   LIG    1       -2.222  -3.053   0.576  0.00  0.00    +0.088 A 
ATOM      9  C   LIG    1       -1.257  -2.223  -0.054  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -0.833  -2.966  -1.134  0.00  0.00    +0.142 A 
ATOM     11  C   LIG    1        0.133  -2.753  -2.231  0.00  0.00    +0.090 C 
ATOM     12  O   LIG    1       -1.494  -4.155  -1.145  0.00  0.00    -0.359 OA
ATOM     13  N   LIG    1       -2.370  -4.211  -0.079  0.00  0.00    -0.083 NA
ENDBRANCH   1   9
BRANCH   3  14
ATOM     14  C   LIG    1        2.536   0.900   0.925  0.00  0.00    +0.175 C 
BRANCH  14  15
ATOM     15  C   LIG    1        3.362   0.553  -0.304  0.00  0.00    -0.015 A 
ATOM     16  C   LIG    1        4.264  -0.523  -0.315  0.00  0.00    +0.006 A 
ATOM     17  C   LIG    1        4.997  -0.830  -1.464  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        4.838  -0.066  -2.618  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        3.949   1.006  -2.625  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        3.217   1.314  -1.477  0.00  0.00    +0.006 A 
ENDBRANCH  14  15
BRANCH  14  21
ATOM     21  O   LIG    1        2.994   0.195   2.080  0.00  0.00    -0.383 OA
ATOM     22  H   LIG    1        2.242   0.134   2.692  0.00  0.00    +0.211 HD
ENDBRANCH  14  21
ENDBRANCH   3  14
BRANCH   5  23
ATOM     23  O   LIG    1       -2.031   2.554   0.886  0.00  0.00    -0.490 OA
BRANCH  23  24
ATOM     24  C   LIG    1       -3.447   2.382   0.760  0.00  0.00    +0.256 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.125   3.727   1.020  0.00  0.00    +0.196 C 
BRANCH  25  26
ATOM     26  O   LIG    1       -4.118   4.020   2.416  0.00  0.00    -0.392 OA
ATOM     27  H   LIG    1       -4.433   4.934   2.518  0.00  0.00    +0.210 HD
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   5  23
TORSDOF 8