REMARK  Name = BDB020219
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.160  -0.979  -0.025  0.00  0.00    +0.404 C 
ATOM      2  N   LIG    1       -1.190  -0.028   0.109  0.00  0.00    -0.259 N 
ATOM      3  C   LIG    1        0.147  -0.223  -0.422  0.00  0.00    +0.147 C 
ATOM      4  C   LIG    1        0.870   1.036  -0.043  0.00  0.00    -0.021 A 
ATOM      5  C   LIG    1       -0.014   1.893   0.634  0.00  0.00    -0.025 A 
ATOM      6  C   LIG    1        0.396   3.130   1.099  0.00  0.00    +0.005 A 
ATOM      7  C   LIG    1        1.720   3.507   0.881  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        2.609   2.652   0.207  0.00  0.00    +0.005 A 
ATOM      9  C   LIG    1        2.196   1.396  -0.277  0.00  0.00    -0.031 A 
ATOM     10  C   LIG    1       -1.368   1.268   0.747  0.00  0.00    +0.147 C 
ATOM     11  O   LIG    1       -1.973  -2.055  -0.577  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   9  12
ATOM     12  C   LIG    1        3.164   0.457  -0.974  0.00  0.00    +0.106 C 
ATOM     13  C   LIG    1        3.984   1.124  -2.080  0.00  0.00    +0.227 C 
ATOM     14  O   LIG    1        3.564   2.031  -2.794  0.00  0.00    -0.275 OA
ATOM     15  N   LIG    1        5.238   0.603  -2.307  0.00  0.00    -0.256 N 
ATOM     16  H   LIG    1        5.760   1.032  -3.059  0.00  0.00    +0.157 HD
ATOM     17  C   LIG    1        5.826  -0.484  -1.712  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1        6.918  -0.899  -2.089  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1        5.028  -1.172  -0.634  0.00  0.00    +0.097 C 
ATOM     20  C   LIG    1        4.090  -0.197   0.058  0.00  0.00    +0.026 C 
ENDBRANCH   9  12
BRANCH   1  21
ATOM     21  O   LIG    1       -3.333  -0.577   0.527  0.00  0.00    -0.445 OA
BRANCH  21  23
ATOM     22  C   LIG    1       -4.959  -1.704  -0.941  0.00  0.00    +0.055 C 
ATOM     23  C   LIG    1       -4.504  -1.432   0.497  0.00  0.00    +0.107 C 
ATOM     24  C   LIG    1       -4.268  -2.728   1.280  0.00  0.00    +0.055 C 
ATOM     25  C   LIG    1       -5.595  -0.620   1.212  0.00  0.00    +0.055 C 
ENDBRANCH  21  23
ENDBRANCH   1  21
TORSDOF 3