REMARK  Name = BDB013098
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.494   0.305   0.119  0.00  0.00    +0.046 A 
ATOM      2  C   LIG    1       -0.253  -0.876  -0.149  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1       -1.620  -0.790  -0.054  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1       -2.083  -2.051  -0.285  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1       -1.079  -2.851  -0.563  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1       -2.292   0.393   0.261  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1       -1.609   1.471   0.534  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        0.080  -2.108  -0.478  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1       -0.231   1.394   0.464  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        4.777   0.430   0.094  0.00  0.00    +0.121 A 
ATOM     11  N   LIG    1        4.119  -0.610   0.648  0.00  0.00    -0.240 NA
ATOM     12  C   LIG    1        2.762  -0.623   0.626  0.00  0.00    +0.121 A 
ATOM     13  C   LIG    1        1.971   0.388   0.095  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        2.656   1.460  -0.475  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1        4.055   1.481  -0.469  0.00  0.00    +0.044 A 
BRANCH  10  18
ATOM     16  C   LIG    1        7.152  -0.651   2.097  0.00  0.00    +0.028 C 
ATOM     17  C   LIG    1        6.865  -0.764   0.602  0.00  0.00    +0.072 C 
ATOM     18  N   LIG    1        6.157   0.439   0.138  0.00  0.00    -0.312 N 
ATOM     19  C   LIG    1        6.954   1.183  -0.830  0.00  0.00    +0.107 C 
ATOM     20  C   LIG    1        8.374   0.688  -0.585  0.00  0.00    +0.021 C 
ATOM     21  C   LIG    1        8.159  -0.774  -0.230  0.00  0.00    +0.024 C 
ENDBRANCH  10  18
ENDBRANCH   1  13
BRANCH   6  22
ATOM     22  N   LIG    1       -3.669   0.431   0.309  0.00  0.00    -0.310 N 
ATOM     23  H   LIG    1       -3.934   1.298   0.777  0.00  0.00    +0.149 HD
BRANCH  22  24
ATOM     24  C   LIG    1       -4.425   0.355  -0.938  0.00  0.00    +0.140 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -5.881   0.605  -0.656  0.00  0.00    -0.024 A 
ATOM     26  C   LIG    1       -6.686  -0.344  -0.032  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1       -6.347  -1.683   0.505  0.00  0.00    +0.080 C 
ATOM     28  C   LIG    1       -7.758  -2.217   0.754  0.00  0.00    +0.234 C 
ATOM     29  O   LIG    1       -8.668  -1.103   0.889  0.00  0.00    -0.491 OA
ATOM     30  C   LIG    1       -8.018  -0.076   0.254  0.00  0.00    +0.124 A 
ATOM     31  C   LIG    1       -8.609   1.130  -0.057  0.00  0.00    +0.046 A 
ATOM     32  C   LIG    1       -7.825   2.096  -0.688  0.00  0.00    +0.004 A 
ATOM     33  C   LIG    1       -6.475   1.837  -0.983  0.00  0.00    +0.005 A 
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH   6  22
TORSDOF 5