REMARK  Name = BDB018800
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.094  -0.926   0.381  0.00  0.00    -0.012 A 
ATOM      2  C   LIG    1       -0.866  -0.291   0.183  0.00  0.00    -0.017 A 
ATOM      3  C   LIG    1       -0.625   1.038  -0.462  0.00  0.00    +0.057 C 
ATOM      4  C   LIG    1        0.881   1.223  -0.264  0.00  0.00    +0.118 C 
ATOM      5  N   LIG    1        1.426  -0.043   0.255  0.00  0.00    -0.269 N 
ATOM      6  C   LIG    1        2.764  -0.325   0.496  0.00  0.00    +0.241 C 
ATOM      7  O   LIG    1        3.171  -1.394   0.958  0.00  0.00    -0.273 OA
ATOM      8  C   LIG    1        0.341  -0.891   0.560  0.00  0.00    +0.040 A 
ATOM      9  C   LIG    1        0.353  -2.144   1.149  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -0.864  -2.796   1.361  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -2.072  -2.195   0.982  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  14
ATOM     12  C   LIG    1       -3.209  -1.428  -2.310  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1       -3.906  -0.536  -1.313  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1       -3.369  -0.307  -0.021  0.00  0.00    -0.012 A 
ATOM     15  C   LIG    1       -4.078   0.529   0.879  0.00  0.00    -0.042 A 
ATOM     16  C   LIG    1       -3.568   0.800   2.272  0.00  0.00    +0.044 C 
ATOM     17  C   LIG    1       -5.287   1.119   0.478  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1       -5.801   0.891  -0.794  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -5.117   0.068  -1.683  0.00  0.00    +0.004 A 
ENDBRANCH   1  14
BRANCH   6  20
ATOM     20  C   LIG    1        3.770   0.762   0.080  0.00  0.00    +0.170 C 
ATOM     21  N   LIG    1        5.030   0.759   0.897  0.00  0.00    -0.258 N 
ATOM     22  C   LIG    1        6.160   0.389   0.018  0.00  0.00    +0.117 C 
ATOM     23  C   LIG    1        5.707   0.854  -1.354  0.00  0.00    +0.022 C 
ATOM     24  C   LIG    1        4.231   0.506  -1.362  0.00  0.00    +0.034 C 
BRANCH  21  25
ATOM     25  C   LIG    1        5.066   0.731   2.235  0.00  0.00    +0.170 C 
ATOM     26  N   LIG    1        5.101   0.749   3.391  0.00  0.00    -0.174 NA
ENDBRANCH  21  25
ENDBRANCH   6  20
TORSDOF 3