REMARK  Name = BDB026876
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.846  -1.040   0.242  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.733  -2.279   0.170  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.862  -2.950  -1.060  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -2.658  -4.090  -1.176  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -3.328  -4.588  -0.062  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -3.191  -3.952   1.170  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -2.394  -2.811   1.289  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -0.582  -0.213   2.496  0.00  0.00    -0.290 OA
ATOM      9  C   LIG    1       -1.197  -0.105   1.426  0.00  0.00    +0.186 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -2.247   0.918   1.289  0.00  0.00    +0.044 A 
ATOM     11  C   LIG    1       -3.225   1.175   0.262  0.00  0.00    +0.010 A 
ATOM     12  C   LIG    1       -3.958   2.300   0.661  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.999   2.851  -0.098  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -5.320   2.238  -1.309  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -4.626   1.115  -1.738  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1       -3.465   2.704   1.877  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1       -3.815   3.493   2.405  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1       -3.587   0.577  -0.967  0.00  0.00    +0.011 A 
ATOM     19  C   LIG    1       -2.449   1.884   2.265  0.00  0.00    +0.095 A 
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  20
ATOM     20  N   LIG    1        0.573  -1.487   0.337  0.00  0.00    -0.302 NA
ATOM     21  H   LIG    1        0.719  -1.792   1.303  0.00  0.00    +0.123 HD
BRANCH  20  22
ATOM     22  C   LIG    1        1.511  -0.401   0.025  0.00  0.00    +0.101 C 
BRANCH  22  23
ATOM     23  C   LIG    1        2.967  -0.895   0.088  0.00  0.00    +0.123 C 
BRANCH  23  24
ATOM     24  N   LIG    1        3.921   0.208  -0.054  0.00  0.00    -0.300 N 
ATOM     25  C   LIG    1        4.252   0.633  -1.331  0.00  0.00    +0.216 C 
ATOM     26  O   LIG    1        3.725   0.166  -2.342  0.00  0.00    -0.276 OA
ATOM     27  C   LIG    1        5.220   1.794  -1.455  0.00  0.00    +0.096 C 
ATOM     28  C   LIG    1        6.160   1.956  -0.275  0.00  0.00    +0.011 C 
ATOM     29  C   LIG    1        5.356   1.946   1.011  0.00  0.00    +0.019 C 
ATOM     30  C   LIG    1        4.648   0.609   1.144  0.00  0.00    +0.108 C 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7