REMARK  Name = BDB028257
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.196   0.544  -0.323  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -2.167  -0.336   0.195  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -3.324  -0.648  -0.533  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -3.523  -0.071  -1.782  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -4.752  -0.381  -2.531  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -5.637  -1.231  -1.916  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -6.492  -1.454  -2.415  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -5.468  -1.824  -0.703  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -4.962   0.101  -3.639  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -2.573   0.802  -2.318  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -4.378  -1.570  -0.037  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1       -1.418   1.104  -1.592  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  15
ATOM     13  C   LIG    1        2.435   1.070   0.643  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        1.297   0.768  -0.114  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        0.014   0.871   0.447  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -0.048   1.296   1.775  0.00  0.00    +0.119 A 
ATOM     17  N   LIG    1        1.028   1.605   2.538  0.00  0.00    -0.262 NA
ATOM     18  C   LIG    1        2.241   1.485   1.955  0.00  0.00    +0.119 A 
BRANCH  13  22
ATOM     19  C   LIG    1        7.191  -0.095  -0.252  0.00  0.00    +0.174 C 
ATOM     20  N   LIG    1        5.852   0.445  -0.336  0.00  0.00    -0.256 N 
ATOM     21  C   LIG    1        4.830   0.268   0.560  0.00  0.00    +0.145 A 
ATOM     22  C   LIG    1        3.754   0.974   0.053  0.00  0.00    +0.039 A 
ATOM     23  C   LIG    1        4.234   1.516  -1.161  0.00  0.00    +0.144 A 
ATOM     24  N   LIG    1        5.508   1.199  -1.397  0.00  0.00    -0.178 NA
BRANCH  21  25
ATOM     25  C   LIG    1        4.933  -0.520   1.736  0.00  0.00    +0.119 C 
ATOM     26  N   LIG    1        5.048  -1.164   2.693  0.00  0.00    -0.189 NA
ENDBRANCH  21  25
ENDBRANCH  13  22
ENDBRANCH   1  15
BRANCH  11  27
ATOM     27  C   LIG    1       -4.210  -2.261   1.314  0.00  0.00    +0.136 C 
BRANCH  27  28
ATOM     28  N   LIG    1       -4.484  -1.298   2.383  0.00  0.00    -0.325 NA
ATOM     29  H   LIG    1       -5.446  -0.967   2.275  0.00  0.00    +0.119 HD
ATOM     30  H   LIG    1       -4.469  -1.789   3.278  0.00  0.00    +0.119 HD
ENDBRANCH  27  28
ENDBRANCH  11  27
TORSDOF 5