REMARK  Name = BDB000605
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.820   0.802  -1.163  0.00  0.00    +0.219 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        2.194   1.128  -0.912  0.00  0.00    -0.248 N 
ATOM      3  C   LIG    1        3.158   0.242  -0.399  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1        4.414   0.844  -0.354  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1        5.545   0.198   0.108  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1        5.388  -1.117   0.545  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        4.126  -1.741   0.508  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        4.265   2.200  -0.879  0.00  0.00    +0.250 C 
ATOM      9  O   LIG    1        5.130   3.037  -0.996  0.00  0.00    -0.282 OA
ATOM     10  C   LIG    1        2.996  -1.061   0.033  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1        2.769   2.337  -1.258  0.00  0.00    +0.292 C 
ATOM     12  O   LIG    1        2.262   3.316  -1.763  0.00  0.00    -0.266 OA
ENDBRANCH   1   2
BRANCH   1  13
ATOM     13  N   LIG    1        0.191   0.555   0.117  0.00  0.00    -0.328 N 
ATOM     14  H   LIG    1        0.450   1.277   0.783  0.00  0.00    +0.148 HD
BRANCH  13  20
ATOM     15  C   LIG    1       -5.391  -0.767   0.549  0.00  0.00    +0.044 C 
ATOM     16  C   LIG    1       -3.935  -0.422   0.397  0.00  0.00    -0.047 A 
ATOM     17  C   LIG    1       -3.270  -0.554  -0.831  0.00  0.00    -0.046 A 
ATOM     18  C   LIG    1       -3.986  -1.045  -2.060  0.00  0.00    +0.044 C 
ATOM     19  C   LIG    1       -1.907  -0.215  -0.916  0.00  0.00    +0.026 A 
ATOM     20  C   LIG    1       -1.182   0.273   0.183  0.00  0.00    +0.031 A 
ATOM     21  C   LIG    1       -1.845   0.340   1.426  0.00  0.00    -0.029 A 
ATOM     22  C   LIG    1       -1.133   0.776   2.680  0.00  0.00    +0.045 C 
ATOM     23  C   LIG    1       -3.211   0.013   1.514  0.00  0.00    +0.008 A 
ENDBRANCH  13  20
ENDBRANCH   1  13
TORSDOF 3