REMARK  Name = BDB005580
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.779   0.072  -0.463  0.00  0.00    -0.046 A 
ATOM      2  C   LIG    1        2.053  -1.034  -0.009  0.00  0.00    +0.030 A 
ATOM      3  C   LIG    1        0.661  -0.962   0.111  0.00  0.00    +0.051 A 
ATOM      4  C   LIG    1       -0.039   0.214  -0.196  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1       -1.513   0.229  -0.029  0.00  0.00    +0.045 A 
ATOM      6  N   LIG    1       -2.216   1.414  -0.240  0.00  0.00    -0.343 N 
ATOM      7  H   LIG    1       -1.669   2.245  -0.033  0.00  0.00    +0.146 HD
ATOM      8  C   LIG    1       -3.611   1.536   0.171  0.00  0.00    +0.102 C 
ATOM      9  C   LIG    1       -4.349   0.243  -0.153  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1       -3.646  -0.959   0.487  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1       -2.149  -0.902   0.336  0.00  0.00    +0.038 A 
ATOM     12  C   LIG    1       -1.399  -2.151   0.637  0.00  0.00    +0.254 A 
ATOM     13  O   LIG    1       -1.967  -3.182   0.985  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1        0.697   1.312  -0.666  0.00  0.00    +0.012 A 
ATOM     15  N   LIG    1       -0.039  -2.097   0.528  0.00  0.00    -0.322 N 
ATOM     16  H   LIG    1        0.452  -2.955   0.737  0.00  0.00    +0.169 HD
ATOM     17  C   LIG    1        2.089   1.244  -0.791  0.00  0.00    +0.004 A 
ENDROOT
BRANCH   1  19
ATOM     18  C   LIG    1        4.967   0.428   0.709  0.00  0.00    +0.009 C 
ATOM     19  C   LIG    1        4.280   0.008  -0.582  0.00  0.00    +0.032 C 
ENDBRANCH   1  19
TORSDOF 1