REMARK  Name = BDB026870
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.560   0.163   0.246  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.904   1.526   0.834  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.505   1.664   2.096  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.798   2.929   2.610  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -1.482   4.072   1.879  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -0.863   3.953   0.637  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -0.570   2.690   0.120  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  N   LIG    1        0.765  -0.261   0.765  0.00  0.00    -0.303 NA
ATOM      9  H   LIG    1        0.624  -0.586   1.725  0.00  0.00    +0.123 HD
BRANCH   8  10
ATOM     10  C   LIG    1        1.354  -1.349  -0.026  0.00  0.00    +0.086 C 
BRANCH  10  11
ATOM     11  C   LIG    1        2.768  -1.706   0.463  0.00  0.00    +0.050 C 
BRANCH  11  16
ATOM     12  C   LIG    1        6.846   2.021  -1.403  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1        5.817   1.051  -0.905  0.00  0.00    -0.050 A 
ATOM     14  C   LIG    1        5.649  -0.190  -1.529  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        4.669  -1.081  -1.085  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        3.832  -0.744  -0.013  0.00  0.00    -0.046 A 
ATOM     17  C   LIG    1        3.991   0.506   0.599  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1        4.970   1.397   0.153  0.00  0.00    +0.003 A 
ENDBRANCH  11  16
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   1  19
ATOM     19  C   LIG    1       -1.651  -0.902   0.549  0.00  0.00    +0.186 C 
ATOM     20  O   LIG    1       -1.494  -1.716   1.466  0.00  0.00    -0.290 OA
BRANCH  19  21
ATOM     21  C   LIG    1       -2.873  -0.915  -0.270  0.00  0.00    +0.044 A 
ATOM     22  C   LIG    1       -3.949  -1.865  -0.205  0.00  0.00    +0.010 A 
ATOM     23  C   LIG    1       -4.901  -1.492  -1.156  0.00  0.00    +0.047 A 
ATOM     24  C   LIG    1       -6.088  -2.205  -1.365  0.00  0.00    +0.026 A 
ATOM     25  C   LIG    1       -6.313  -3.338  -0.578  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1       -5.386  -3.739   0.380  0.00  0.00    +0.001 A 
ATOM     27  N   LIG    1       -4.434  -0.359  -1.774  0.00  0.00    -0.360 N 
ATOM     28  H   LIG    1       -4.926   0.140  -2.502  0.00  0.00    +0.165 HD
ATOM     29  C   LIG    1       -4.205  -3.014   0.575  0.00  0.00    +0.011 A 
ATOM     30  C   LIG    1       -3.217  -0.004  -1.255  0.00  0.00    +0.095 A 
ENDBRANCH  19  21
ENDBRANCH   1  19
TORSDOF 7