REMARK  Name = BDB026869
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.645  -0.662  -1.369  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.474  -0.862  -2.632  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -2.332  -1.963  -2.790  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -3.075  -2.123  -3.962  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -2.961  -1.196  -4.995  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -2.096  -0.112  -4.863  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -1.353   0.052  -3.693  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  N   LIG    1        0.578  -1.507  -1.454  0.00  0.00    -0.303 NA
ATOM      9  H   LIG    1        0.278  -2.459  -1.223  0.00  0.00    +0.123 HD
BRANCH   8  10
ATOM     10  C   LIG    1        1.619  -1.116  -0.494  0.00  0.00    +0.086 C 
BRANCH  10  11
ATOM     11  C   LIG    1        2.410   0.120  -0.947  0.00  0.00    +0.050 C 
BRANCH  11  16
ATOM     12  C   LIG    1        6.660   1.393   2.831  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1        5.561   1.047   1.870  0.00  0.00    -0.050 A 
ATOM     14  C   LIG    1        5.827   0.270   0.737  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        4.811  -0.028  -0.173  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        3.514   0.459   0.026  0.00  0.00    -0.046 A 
ATOM     17  C   LIG    1        3.249   1.244   1.155  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1        4.266   1.541   2.066  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       -1.457  -0.985  -0.082  0.00  0.00    +0.186 C 
ATOM     20  O   LIG    1       -1.330  -2.078   0.479  0.00  0.00    -0.290 OA
BRANCH  19  21
ATOM     21  C   LIG    1       -2.378   0.033   0.447  0.00  0.00    +0.044 A 
ATOM     22  C   LIG    1       -3.122  -0.028   1.675  0.00  0.00    +0.010 A 
ATOM     23  C   LIG    1       -3.869   1.147   1.777  0.00  0.00    +0.047 A 
ATOM     24  C   LIG    1       -4.713   1.422   2.860  0.00  0.00    +0.026 A 
ATOM     25  C   LIG    1       -4.799   0.465   3.875  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1       -4.069  -0.718   3.807  0.00  0.00    +0.001 A 
ATOM     27  N   LIG    1       -3.600   1.895   0.657  0.00  0.00    -0.360 N 
ATOM     28  H   LIG    1       -4.014   2.796   0.460  0.00  0.00    +0.165 HD
ATOM     29  C   LIG    1       -3.231  -0.975   2.716  0.00  0.00    +0.011 A 
ATOM     30  C   LIG    1       -2.704   1.241  -0.146  0.00  0.00    +0.095 A 
ENDBRANCH  19  21
ENDBRANCH   1  19
TORSDOF 7