REMARK  Name = BDB037923
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.120   0.029   0.575  0.00  0.00    +0.043 A 
ATOM      2  C   LIG    1       -0.899   0.685   0.673  0.00  0.00    +0.066 A 
ATOM      3  C   LIG    1       -0.960   1.814  -0.214  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -2.199   1.777  -0.854  0.00  0.00    +0.047 A 
ATOM      5  C   LIG    1       -2.593   2.724  -1.807  0.00  0.00    +0.026 A 
ATOM      6  C   LIG    1       -1.699   3.756  -2.105  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1       -0.464   3.839  -1.468  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -0.086   2.881  -0.520  0.00  0.00    +0.011 A 
ATOM      9  N   LIG    1       -2.879   0.694  -0.356  0.00  0.00    -0.356 N 
ATOM     10  H   LIG    1       -3.805   0.397  -0.635  0.00  0.00    +0.166 HD
ENDROOT
BRANCH   2  11
ATOM     11  C   LIG    1        0.184   0.275   1.560  0.00  0.00    +0.249 C 
ATOM     12  N   LIG    1        1.455   0.312   1.014  0.00  0.00    -0.295 N 
ATOM     13  C   LIG    1        2.609  -0.369   1.604  0.00  0.00    +0.126 C 
ATOM     14  C   LIG    1        3.255  -0.277   0.207  0.00  0.00    +0.087 C 
ATOM     15  C   LIG    1        4.059  -1.512  -0.294  0.00  0.00    +0.229 C 
ATOM     16  O   LIG    1        3.721  -2.686  -0.344  0.00  0.00    -0.275 OA
ATOM     17  N   LIG    1        5.276  -1.065  -0.706  0.00  0.00    -0.256 N 
ATOM     18  H   LIG    1        5.982  -1.678  -1.083  0.00  0.00    +0.157 HD
ATOM     19  C   LIG    1        5.455   0.282  -0.594  0.00  0.00    +0.220 C 
ATOM     20  O   LIG    1        6.462   0.887  -0.921  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1        4.209   0.903  -0.006  0.00  0.00    +0.115 C 
ATOM     22  C   LIG    1        1.826  -0.093  -0.344  0.00  0.00    +0.126 C 
ATOM     23  O   LIG    1       -0.021  -0.109   2.709  0.00  0.00    -0.270 OA
ENDBRANCH   2  11
BRANCH   1  24
ATOM     24  C   LIG    1       -2.655  -1.172   1.289  0.00  0.00    +0.137 C 
BRANCH  24  26
ATOM     25  C   LIG    1       -4.296  -2.924   1.191  0.00  0.00    +0.105 C 
ATOM     26  N   LIG    1       -3.489  -1.995   0.393  0.00  0.00    -0.303 NA
ATOM     27  C   LIG    1       -2.653  -2.760  -0.542  0.00  0.00    +0.105 C 
ENDBRANCH  24  26
ENDBRANCH   1  24
TORSDOF 3