REMARK  Name = BDB006974
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.038   0.013  -0.646  0.00  0.00    +0.234 C 
ATOM      2  N   LIG    1       -1.274   0.072  -0.003  0.00  0.00    -0.269 N 
ATOM      3  C   LIG    1       -2.514  -0.275  -0.573  0.00  0.00    +0.041 A 
ATOM      4  C   LIG    1       -3.548  -0.067   0.345  0.00  0.00    -0.019 A 
ATOM      5  C   LIG    1       -4.869  -0.343   0.010  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -5.147  -0.836  -1.266  0.00  0.00    +0.019 A 
ATOM      7  C   LIG    1       -4.110  -1.044  -2.192  0.00  0.00    +0.054 A 
ATOM      8  C   LIG    1       -3.027   0.487   1.650  0.00  0.00    +0.008 C 
ATOM      9  C   LIG    1       -3.385  -0.416   2.834  0.00  0.00    +0.017 C 
ATOM     10  C   LIG    1       -3.544   1.911   1.887  0.00  0.00    +0.017 C 
ATOM     11  C   LIG    1       -2.782  -0.761  -1.844  0.00  0.00    +0.042 A 
ATOM     12  C   LIG    1       -1.499   0.489   1.393  0.00  0.00    +0.124 C 
ATOM     13  O   LIG    1        0.096  -0.332  -1.821  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   7  14
ATOM     14  C   LIG    1       -4.416  -1.552  -3.498  0.00  0.00    +0.099 C 
ATOM     15  N   LIG    1       -4.684  -1.965  -4.548  0.00  0.00    -0.191 NA
ENDBRANCH   7  14
BRANCH   1  16
ATOM     16  C   LIG    1        1.164   0.428   0.235  0.00  0.00    +0.181 C 
BRANCH  16  23
ATOM     17  C   LIG    1        6.091   0.893   0.579  0.00  0.00    +0.025 C 
ATOM     18  C   LIG    1        4.914   0.802  -0.392  0.00  0.00    +0.065 C 
ATOM     19  N   LIG    1        5.088  -0.371  -1.281  0.00  0.00    -0.311 NA
ATOM     20  H   LIG    1        4.659  -0.111  -2.174  0.00  0.00    +0.122 HD
ATOM     21  C   LIG    1        4.292  -1.504  -0.780  0.00  0.00    +0.096 C 
ATOM     22  C   LIG    1        2.777  -1.183  -0.676  0.00  0.00    +0.100 C 
ATOM     23  N   LIG    1        2.476   0.245  -0.421  0.00  0.00    -0.291 NA
ATOM     24  C   LIG    1        3.559   0.846   0.374  0.00  0.00    +0.103 C 
ENDBRANCH  16  23
ENDBRANCH   1  16
TORSDOF 3