REMARK  Name = BDB024484
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.563   1.248  -0.108  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        3.695   0.218  -0.513  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        4.076  -0.674  -1.636  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        5.233  -1.609  -1.238  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        2.943  -1.560  -2.178  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        1.637  -0.800  -2.206  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        1.327  -0.390  -0.797  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        0.018  -0.456  -0.276  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1       -1.135  -0.890  -0.881  0.00  0.00    -0.231 NA
ATOM     10  C   LIG    1       -2.102  -0.747   0.008  0.00  0.00    +0.118 A 
ATOM     11  N   LIG    1       -1.592  -0.247   1.191  0.00  0.00    -0.330 N 
ATOM     12  C   LIG    1       -2.323   0.048   2.400  0.00  0.00    +0.150 C 
ATOM     13  C   LIG    1       -0.240  -0.040   1.022  0.00  0.00    +0.069 A 
ATOM     14  C   LIG    1        0.760   0.462   1.856  0.00  0.00    +0.030 A 
ATOM     15  C   LIG    1        2.057   0.533   1.327  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1        2.361   0.123   0.020  0.00  0.00    +0.045 A 
ATOM     17  O   LIG    1        4.351   2.075   0.773  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  19
ATOM     18  C   LIG    1        6.619   2.325  -0.499  0.00  0.00    +0.282 C 
ATOM     19  O   LIG    1        5.713   1.279  -0.850  0.00  0.00    -0.453 OA
ENDBRANCH   1  19
BRANCH  10  20
ATOM     20  C   LIG    1       -3.550  -1.095  -0.271  0.00  0.00    +0.082 C 
ATOM     21  C   LIG    1       -3.873  -2.486   0.290  0.00  0.00    +0.020 C 
BRANCH  20  22
ATOM     22  C   LIG    1       -4.528   0.022   0.082  0.00  0.00    -0.037 A 
ATOM     23  C   LIG    1       -5.584  -0.140   0.993  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -6.450   0.920   1.280  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -6.279   2.154   0.659  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -5.245   2.331  -0.255  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -4.380   1.274  -0.543  0.00  0.00    +0.004 A 
ENDBRANCH  20  22
ENDBRANCH  10  20
TORSDOF 3