REMARK  Name = BDB028159
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.790   0.899  -1.392  0.00  0.00    +0.083 A 
ATOM      2  C   LIG    1       -3.148  -0.259  -0.719  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -3.813  -1.479  -0.784  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1       -3.267  -2.617  -0.183  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1       -2.049  -2.528   0.494  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -1.363  -1.305   0.587  0.00  0.00    -0.016 A 
ATOM      7  C   LIG    1       -5.105  -1.558  -1.484  0.00  0.00    +0.272 A 
ATOM      8  O   LIG    1       -5.721  -2.614  -1.571  0.00  0.00    -0.266 OA
ATOM      9  N   LIG    1       -5.574  -0.385  -2.023  0.00  0.00    -0.242 N 
ATOM     10  H   LIG    1       -6.466  -0.419  -2.506  0.00  0.00    +0.192 HD
ATOM     11  C   LIG    1       -1.931  -0.173  -0.028  0.00  0.00    +0.019 A 
ATOM     12  N   LIG    1       -4.942   0.820  -1.994  0.00  0.00    -0.174 NA
ENDROOT
BRANCH   6  13
ATOM     13  C   LIG    1       -0.086  -1.210   1.311  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1        1.069  -0.682   0.705  0.00  0.00    +0.034 A 
ATOM     15  C   LIG    1        2.286  -0.578   1.393  0.00  0.00    +0.049 A 
ATOM     16  C   LIG    1        2.264  -1.067   2.705  0.00  0.00    +0.133 A 
ATOM     17  N   LIG    1        1.185  -1.581   3.344  0.00  0.00    -0.261 NA
ATOM     18  C   LIG    1        0.040  -1.635   2.631  0.00  0.00    +0.119 A 
BRANCH  15  19
ATOM     19  N   LIG    1        3.464  -0.068   0.824  0.00  0.00    -0.324 N 
ATOM     20  C   LIG    1        3.487   0.195  -0.632  0.00  0.00    +0.133 C 
ATOM     21  C   LIG    1        4.916   0.535  -1.086  0.00  0.00    +0.178 C 
ATOM     22  O   LIG    1        5.438   1.660  -0.362  0.00  0.00    -0.377 OA
ATOM     23  C   LIG    1        5.482   1.359   1.041  0.00  0.00    +0.178 C 
ATOM     24  C   LIG    1        4.085   1.038   1.598  0.00  0.00    +0.133 C 
ENDBRANCH  15  19
ENDBRANCH   6  13
BRANCH   1  25
ATOM     25  C   LIG    1       -3.097   2.259  -1.395  0.00  0.00    +0.136 C 
BRANCH  25  26
ATOM     26  N   LIG    1       -3.283   2.897  -0.091  0.00  0.00    -0.325 NA
ATOM     27  H   LIG    1       -4.287   2.996   0.076  0.00  0.00    +0.119 HD
ATOM     28  H   LIG    1       -2.922   3.850  -0.136  0.00  0.00    +0.119 HD
ENDBRANCH  25  26
ENDBRANCH   1  25
TORSDOF 4