REMARK  Name = BDB006908
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.447  -0.483  -0.514  0.00  0.00    +0.073 A 
ATOM      2  N   LIG    1        3.717   0.626  -1.258  0.00  0.00    -0.255 NA
ATOM      3  C   LIG    1        2.745   1.551  -1.396  0.00  0.00    +0.117 A 
ATOM      4  C   LIG    1        1.505   1.409  -0.818  0.00  0.00    -0.001 A 
ATOM      5  C   LIG    1        0.333   2.351  -0.838  0.00  0.00    +0.009 C 
ATOM      6  C   LIG    1       -0.747   1.491  -0.132  0.00  0.00    +0.124 C 
ATOM      7  N   LIG    1       -0.067   0.311   0.444  0.00  0.00    -0.269 N 
ATOM      8  C   LIG    1       -0.662  -0.662   1.235  0.00  0.00    +0.234 C 
ATOM      9  O   LIG    1       -0.100  -1.695   1.608  0.00  0.00    -0.274 OA
ATOM     10  C   LIG    1        0.641   3.616  -0.027  0.00  0.00    +0.017 C 
ATOM     11  C   LIG    1       -0.097   2.720  -2.260  0.00  0.00    +0.017 C 
ATOM     12  C   LIG    1        1.248   0.273  -0.060  0.00  0.00    +0.044 A 
ATOM     13  C   LIG    1        2.221  -0.692   0.115  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   1  15
ATOM     14  C   LIG    1        4.326  -2.768  -0.518  0.00  0.00    +0.019 C 
ATOM     15  C   LIG    1        4.570  -1.449  -0.380  0.00  0.00    +0.000 C 
BRANCH  15  16
ATOM     16  C   LIG    1        5.969  -1.039  -0.102  0.00  0.00    -0.016 A 
ATOM     17  C   LIG    1        7.024  -1.416  -0.947  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1        8.334  -1.019  -0.670  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        8.604  -0.237   0.452  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        7.564   0.154   1.293  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        6.253  -0.242   1.016  0.00  0.00    +0.008 A 
ENDBRANCH  15  16
ENDBRANCH   1  15
BRANCH   8  22
ATOM     22  C   LIG    1       -2.107  -0.392   1.687  0.00  0.00    +0.181 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.047  -0.416   0.554  0.00  0.00    -0.286 NA
ATOM     24  C   LIG    1       -4.366   0.168   0.912  0.00  0.00    +0.097 C 
ATOM     25  C   LIG    1       -5.333  -0.855   1.562  0.00  0.00    +0.102 C 
ATOM     26  N   LIG    1       -5.520  -2.099   0.799  0.00  0.00    -0.311 NA
ATOM     27  H   LIG    1       -5.964  -1.869  -0.090  0.00  0.00    +0.122 HD
ATOM     28  C   LIG    1       -4.218  -2.733   0.502  0.00  0.00    +0.065 C 
ATOM     29  C   LIG    1       -3.705  -3.510   1.716  0.00  0.00    +0.025 C 
ATOM     30  C   LIG    1       -3.176  -1.739  -0.086  0.00  0.00    +0.103 C 
BRANCH  24  31
ATOM     31  C   LIG    1       -5.013   0.837  -0.328  0.00  0.00    +0.179 C 
BRANCH  31  32
ATOM     32  O   LIG    1       -4.227   1.968  -0.733  0.00  0.00    -0.381 OA
ATOM     33  C   LIG    1       -4.743   2.567  -1.913  0.00  0.00    +0.194 C 
ENDBRANCH  31  32
ENDBRANCH  24  31
ENDBRANCH  22  23
ENDBRANCH   8  22
TORSDOF 6