REMARK  Name = BDB062195
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.464  -1.777  -0.575  0.00  0.00    +0.194 C 
ATOM      2  N   LIG    1       -1.351  -3.115  -0.827  0.00  0.00    -0.252 N 
ATOM      3  H   LIG    1       -2.080  -3.767  -1.044  0.00  0.00    +0.158 HD
ATOM      4  C   LIG    1       -0.051  -3.494  -0.743  0.00  0.00    +0.269 C 
ATOM      5  O   LIG    1        0.424  -4.599  -0.907  0.00  0.00    -0.268 OA
ATOM      6  C   LIG    1        0.626  -2.220  -0.408  0.00  0.00    +0.130 C 
ATOM      7  C   LIG    1        1.953  -2.139  -0.252  0.00  0.00    +0.041 C 
ATOM      8  N   LIG    1       -0.312  -1.219  -0.322  0.00  0.00    -0.213 NA
ENDROOT
BRANCH   7   9
ATOM      9  C   LIG    1        2.737  -0.931   0.058  0.00  0.00    -0.019 A 
ATOM     10  C   LIG    1        2.234   0.124   0.836  0.00  0.00    +0.057 A 
ATOM     11  C   LIG    1        3.061   1.198   1.098  0.00  0.00    +0.167 A 
ATOM     12  O   LIG    1        2.729   2.297   1.828  0.00  0.00    -0.453 OA
ATOM     13  C   LIG    1        3.955   3.051   1.756  0.00  0.00    +0.466 C 
ATOM     14  O   LIG    1        4.992   2.393   1.000  0.00  0.00    -0.453 OA
ATOM     15  C   LIG    1        4.351   1.253   0.628  0.00  0.00    +0.166 A 
ATOM     16  C   LIG    1        4.889   0.235  -0.126  0.00  0.00    +0.050 A 
ATOM     17  C   LIG    1        4.072  -0.866  -0.407  0.00  0.00    +0.012 A 
ENDBRANCH   7   9
BRANCH   1  19
ATOM     18  C   LIG    1       -3.951  -1.901  -0.741  0.00  0.00    +0.138 C 
ATOM     19  N   LIG    1       -2.705  -1.155  -0.592  0.00  0.00    -0.276 N 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.866   0.216  -0.249  0.00  0.00    +0.036 A 
ATOM     21  C   LIG    1       -1.974   1.191  -0.726  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -2.121   2.544  -0.400  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -3.171   2.954   0.414  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -4.069   2.013   0.903  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1       -3.917   0.660   0.576  0.00  0.00    +0.023 A 
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 3