REMARK  Name = BDB009027
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.491  -0.135  -2.097  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -0.826   0.325  -2.023  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1       -1.906  -0.521  -2.338  0.00  0.00    -0.040 A 
ATOM      4  C   LIG    1       -1.640  -1.828  -2.770  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.329  -2.292  -2.850  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        0.730  -1.451  -2.510  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   9
ATOM      7  O   LIG    1        0.700   2.675  -1.080  0.00  0.00    -0.274 OA
ATOM      8  C   LIG    1        1.660   1.944  -1.308  0.00  0.00    +0.234 C 
ATOM      9  N   LIG    1        1.619   0.645  -1.783  0.00  0.00    -0.284 N 
ATOM     10  H   LIG    1        2.528   0.187  -1.879  0.00  0.00    +0.155 HD
BRANCH   8  11
ATOM     11  C   LIG    1        3.093   2.453  -1.108  0.00  0.00    +0.200 C 
BRANCH  11  12
ATOM     12  N   LIG    1        3.799   1.728  -0.062  0.00  0.00    -0.303 N 
ATOM     13  H   LIG    1        3.962   2.213   0.809  0.00  0.00    +0.150 HD
ATOM     14  C   LIG    1        4.402   0.515  -0.306  0.00  0.00    +0.244 C 
ATOM     15  O   LIG    1        4.303  -0.058  -1.388  0.00  0.00    -0.270 OA
BRANCH  14  16
ATOM     16  C   LIG    1        5.184  -0.087   0.806  0.00  0.00    +0.037 A 
ATOM     17  C   LIG    1        4.870   0.149   2.150  0.00  0.00    +0.013 A 
ATOM     18  C   LIG    1        5.633  -0.443   3.159  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        6.703  -1.275   2.830  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        7.009  -1.526   1.493  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        6.249  -0.937   0.482  0.00  0.00    +0.013 A 
ENDBRANCH  14  16
ENDBRANCH  11  12
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   3  22
ATOM     22  C   LIG    1       -3.336  -0.029  -2.279  0.00  0.00    +0.092 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.666   0.810  -1.048  0.00  0.00    +0.069 A 
ATOM     24  C   LIG    1       -3.898   0.135   0.269  0.00  0.00    -0.016 A 
ATOM     25  C   LIG    1       -3.808  -1.359   0.399  0.00  0.00    +0.037 C 
ATOM     26  C   LIG    1       -3.786  -1.846   1.851  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1       -4.796  -1.090   2.705  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -4.510   0.412   2.686  0.00  0.00    +0.041 C 
ATOM     29  C   LIG    1       -4.199   0.931   1.309  0.00  0.00    +0.023 A 
ATOM     30  C   LIG    1       -4.253   2.404   1.131  0.00  0.00    +0.268 A 
ATOM     31  O   LIG    1       -4.493   3.160   2.067  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -4.030   2.861  -0.140  0.00  0.00    -0.243 N 
ATOM     33  H   LIG    1       -4.045   3.864  -0.283  0.00  0.00    +0.192 HD
ATOM     34  N   LIG    1       -3.741   2.096  -1.225  0.00  0.00    -0.175 NA
ENDBRANCH  22  23
ENDBRANCH   3  22
TORSDOF 6