REMARK  Name = BDB009084
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.060   1.119   0.528  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -0.077   0.675   1.220  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -1.242   1.458   1.289  0.00  0.00    -0.040 A 
ATOM      4  C   LIG    1       -1.243   2.719   0.683  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.118   3.167  -0.007  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        1.026   2.369  -0.088  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        3.399   0.471  -0.117  0.00  0.00    +0.218 C 
ATOM      8  N   LIG    1        2.179   0.259   0.509  0.00  0.00    -0.285 N 
ATOM      9  H   LIG    1        2.075  -0.612   1.014  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        3.714   1.448  -0.784  0.00  0.00    -0.275 OA
BRANCH   7  11
ATOM     11  C   LIG    1        4.347  -0.695   0.117  0.00  0.00    +0.111 C 
BRANCH  11  12
ATOM     12  C   LIG    1        5.699  -0.470  -0.568  0.00  0.00    +0.093 C 
BRANCH  12  14
ATOM     13  C   LIG    1        6.296  -2.802  -1.010  0.00  0.00    +0.104 C 
ATOM     14  N   LIG    1        6.702  -1.538  -0.407  0.00  0.00    -0.308 NA
ATOM     15  C   LIG    1        7.128  -1.720   0.977  0.00  0.00    +0.104 C 
ENDBRANCH  12  14
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   1   8
BRANCH   3  16
ATOM     16  C   LIG    1       -2.449   0.962   2.051  0.00  0.00    +0.092 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -3.767   1.123   1.297  0.00  0.00    +0.069 A 
ATOM     18  C   LIG    1       -4.058   0.253   0.114  0.00  0.00    -0.016 A 
ATOM     19  C   LIG    1       -3.091  -0.810  -0.324  0.00  0.00    +0.037 C 
ATOM     20  C   LIG    1       -3.699  -1.814  -1.309  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1       -4.521  -1.103  -2.377  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1       -5.653  -0.290  -1.747  0.00  0.00    +0.041 C 
ATOM     23  C   LIG    1       -5.222   0.471  -0.523  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -6.159   1.511  -0.029  0.00  0.00    +0.268 A 
ATOM     25  O   LIG    1       -7.237   1.723  -0.575  0.00  0.00    -0.266 OA
ATOM     26  N   LIG    1       -5.750   2.209   1.075  0.00  0.00    -0.243 N 
ATOM     27  H   LIG    1       -6.375   2.925   1.427  0.00  0.00    +0.192 HD
ATOM     28  N   LIG    1       -4.577   2.039   1.739  0.00  0.00    -0.175 NA
ENDBRANCH  16  17
ENDBRANCH   3  16
TORSDOF 6