REMARK  Name = BDB064456
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.732  -0.226   0.090  0.00  0.00    +0.217 A 
ATOM      2  N   LIG    1        1.752  -1.539   0.333  0.00  0.00    -0.214 NA
ATOM      3  C   LIG    1        0.582  -2.179   0.393  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1       -0.643  -1.533   0.219  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1       -1.846  -2.288   0.272  0.00  0.00    +0.022 A 
ATOM      6  C   LIG    1       -1.845  -3.669   0.513  0.00  0.00    -0.017 A 
ATOM      7  C   LIG    1       -0.605  -4.287   0.698  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1       -0.560  -0.149  -0.007  0.00  0.00    +0.132 A 
ATOM      9  C   LIG    1        0.582  -3.545   0.634  0.00  0.00    +0.029 A 
ATOM     10  N   LIG    1        0.620   0.488  -0.089  0.00  0.00    -0.199 NA
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1       -3.099  -4.437   0.565  0.00  0.00    -0.018 A 
ATOM     12  C   LIG    1       -3.393  -5.270   1.658  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1       -4.585  -5.999   1.709  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -5.504  -5.907   0.667  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1       -5.232  -5.088  -0.426  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -4.040  -4.360  -0.475  0.00  0.00    +0.008 A 
ENDBRANCH   6  11
BRANCH   1  17
ATOM     17  N   LIG    1        2.919   0.493   0.011  0.00  0.00    -0.313 N 
ATOM     18  H   LIG    1        2.677   1.359  -0.459  0.00  0.00    +0.149 HD
BRANCH  17  19
ATOM     19  C   LIG    1        4.028  -0.241  -0.573  0.00  0.00    +0.105 C 
BRANCH  19  20
ATOM     20  C   LIG    1        5.257   0.662  -0.706  0.00  0.00    +0.034 C 
BRANCH  20  21
ATOM     21  C   LIG    1        5.836   1.054   0.660  0.00  0.00    +0.085 C 
BRANCH  21  23
ATOM     22  C   LIG    1        7.309   2.533   1.858  0.00  0.00    +0.104 C 
ATOM     23  N   LIG    1        7.001   1.955   0.546  0.00  0.00    -0.308 NA
ATOM     24  C   LIG    1        8.184   1.262   0.029  0.00  0.00    +0.104 C 
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   1  17
BRANCH   8  25
ATOM     25  N   LIG    1       -1.753   0.592  -0.184  0.00  0.00    -0.328 N 
ATOM     26  H   LIG    1       -2.360   0.413   0.612  0.00  0.00    +0.147 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.561   2.027  -0.394  0.00  0.00    +0.106 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -2.923   2.710  -0.589  0.00  0.00    +0.008 C 
ATOM     29  C   LIG    1       -2.767   4.232  -0.675  0.00  0.00    +0.020 C 
ATOM     30  C   LIG    1       -4.130   4.921  -0.813  0.00  0.00    +0.081 C 
ATOM     31  N   LIG    1       -5.125   4.143  -1.552  0.00  0.00    -0.316 NA
ATOM     32  H   LIG    1       -5.782   4.773  -2.009  0.00  0.00    +0.122 HD
ATOM     33  C   LIG    1       -4.514   3.251  -2.528  0.00  0.00    +0.081 C 
ATOM     34  C   LIG    1       -3.663   2.183  -1.837  0.00  0.00    +0.020 C 
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   8  25
TORSDOF 9