REMARK  Name = BDB057609
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.271  -1.200   0.081  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1        1.895  -1.246  -0.036  0.00  0.00    +0.148 A 
ATOM      3  N   LIG    1        1.589  -2.519  -0.422  0.00  0.00    -0.262 N 
ATOM      4  H   LIG    1        0.658  -2.879  -0.595  0.00  0.00    +0.190 HD
ATOM      5  N   LIG    1        2.659  -3.319  -0.569  0.00  0.00    -0.177 NA
ATOM      6  C   LIG    1        3.691  -2.520  -0.264  0.00  0.00    +0.076 A 
ATOM      7  C   LIG    1        5.077  -3.053  -0.312  0.00  0.00    +0.068 C 
ENDROOT
BRANCH   1   8
ATOM      8  C   LIG    1        4.100  -0.075   0.463  0.00  0.00    +0.344 C 
ATOM      9  O   LIG    1        5.322  -0.133   0.532  0.00  0.00    -0.245 OA
BRANCH   8  10
ATOM     10  O   LIG    1        3.373   1.054   0.734  0.00  0.00    -0.461 OA
BRANCH  10  12
ATOM     11  C   LIG    1        4.583   2.974  -0.110  0.00  0.00    +0.048 C 
ATOM     12  C   LIG    1        4.135   2.207   1.120  0.00  0.00    +0.229 C 
ENDBRANCH  10  12
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   2  13
ATOM     13  N   LIG    1        0.918  -0.329   0.150  0.00  0.00    -0.221 N 
ATOM     14  H   LIG    1        1.196   0.613   0.439  0.00  0.00    +0.176 HD
BRANCH  13  15
ATOM     15  N   LIG    1       -0.395  -0.626  -0.035  0.00  0.00    -0.189 NA
ATOM     16  C   LIG    1       -1.214   0.355   0.181  0.00  0.00    +0.138 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -2.674   0.204   0.026  0.00  0.00    -0.005 A 
ATOM     18  C   LIG    1       -3.234  -1.014  -0.363  0.00  0.00    +0.013 A 
ATOM     19  C   LIG    1       -4.620  -1.124  -0.500  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1       -5.452  -0.028  -0.253  0.00  0.00    +0.120 A 
ATOM     21  C   LIG    1       -4.885   1.188   0.136  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1       -3.497   1.305   0.276  0.00  0.00    +0.013 A 
BRANCH  20  23
ATOM     23  O   LIG    1       -6.785  -0.275  -0.426  0.00  0.00    -0.495 OA
ATOM     24  C   LIG    1       -7.679   0.806  -0.188  0.00  0.00    +0.277 C 
ENDBRANCH  20  23
ENDBRANCH  16  17
ENDBRANCH  13  15
ENDBRANCH   2  13
TORSDOF 7