REMARK  Name = BDB063350
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.899  -0.147   0.132  0.00  0.00    +0.047 A 
ATOM      2  C   LIG    1       -0.056  -1.241   0.494  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1        1.293  -0.995   0.574  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1        1.858  -2.162   0.999  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1        0.935  -3.090   1.107  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        1.868   0.245   0.288  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1        1.104   1.252  -0.032  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1       -0.274  -2.509   0.791  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1       -0.257   1.021  -0.109  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  17
ATOM     10  C   LIG    1       -5.319  -1.995  -1.075  0.00  0.00    +0.149 C 
ATOM     11  N   LIG    1       -4.315  -1.097  -0.549  0.00  0.00    -0.349 N 
ATOM     12  C   LIG    1       -4.578   0.095   0.093  0.00  0.00    +0.049 A 
ATOM     13  C   LIG    1       -3.343   0.639   0.468  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1       -3.340   1.859   1.182  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -4.548   2.499   1.477  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -5.758   1.943   1.079  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1       -2.329  -0.261   0.006  0.00  0.00    +0.012 A 
ATOM     18  C   LIG    1       -5.796   0.731   0.384  0.00  0.00    +0.026 A 
ATOM     19  C   LIG    1       -2.967  -1.320  -0.605  0.00  0.00    +0.095 A 
ENDBRANCH   1  17
BRANCH   6  20
ATOM     20  N   LIG    1        3.232   0.416   0.361  0.00  0.00    -0.307 N 
ATOM     21  H   LIG    1        3.420   1.421   0.372  0.00  0.00    +0.149 HD
BRANCH  20  22
ATOM     22  C   LIG    1        4.069  -0.139  -0.706  0.00  0.00    +0.178 C 
BRANCH  22  23
ATOM     23  C   LIG    1        5.506   0.215  -0.561  0.00  0.00    +0.122 A 
ATOM     24  O   LIG    1        5.827   1.527  -0.760  0.00  0.00    -0.466 OA
ATOM     25  C   LIG    1        7.168   1.639  -0.576  0.00  0.00    +0.195 A 
ATOM     26  C   LIG    1        7.714   0.418  -0.259  0.00  0.00    +0.041 A 
ATOM     27  C   LIG    1        6.639  -0.505  -0.246  0.00  0.00    +0.046 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   6  20
TORSDOF 4