REMARK  Name = BDB049262
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.377   0.847  -0.546  0.00  0.00    +0.028 A 
ATOM      2  C   LIG    1        1.095   0.943  -1.776  0.00  0.00    +0.170 A 
ATOM      3  N   LIG    1        2.470   1.139  -1.726  0.00  0.00    -0.268 N 
ATOM      4  C   LIG    1        2.838   1.227  -3.047  0.00  0.00    +0.231 A 
ATOM      5  N   LIG    1        1.801   1.059  -3.833  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        3.248   1.235  -0.535  0.00  0.00    +0.124 A 
ATOM      7  C   LIG    1        2.542   1.160   0.626  0.00  0.00    +0.091 A 
ATOM      8  N   LIG    1        0.702   0.882  -3.033  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        1.091   0.946   0.596  0.00  0.00    +0.034 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1       -3.862   0.124  -0.275  0.00  0.00    -0.033 A 
ATOM     11  C   LIG    1       -3.281   1.192   0.419  0.00  0.00    +0.005 A 
ATOM     12  C   LIG    1       -1.906   1.432   0.332  0.00  0.00    +0.009 A 
ATOM     13  C   LIG    1       -1.082   0.607  -0.448  0.00  0.00    -0.014 A 
ATOM     14  C   LIG    1       -1.669  -0.451  -1.154  0.00  0.00    +0.009 A 
ATOM     15  C   LIG    1       -3.043  -0.691  -1.067  0.00  0.00    +0.005 A 
BRANCH  10  16
ATOM     16  C   LIG    1       -5.354  -0.130  -0.200  0.00  0.00    +0.119 C 
BRANCH  16  18
ATOM     17  C   LIG    1       -7.120  -1.736   0.102  0.00  0.00    +0.104 C 
ATOM     18  N   LIG    1       -5.694  -1.473   0.304  0.00  0.00    -0.304 NA
ATOM     19  C   LIG    1       -5.358  -1.615   1.723  0.00  0.00    +0.104 C 
ENDBRANCH  16  18
ENDBRANCH  10  16
ENDBRANCH   1  13
BRANCH   6  20
ATOM     20  N   LIG    1        4.634   1.412  -0.707  0.00  0.00    -0.322 N 
ATOM     21  H   LIG    1        4.960   1.065  -1.609  0.00  0.00    +0.148 HD
BRANCH  20  22
ATOM     22  C   LIG    1        5.709   1.209   0.268  0.00  0.00    +0.179 C 
BRANCH  22  23
ATOM     23  C   LIG    1        5.964  -0.207   0.618  0.00  0.00    +0.142 A 
ATOM     24  O   LIG    1        6.167  -1.089  -0.413  0.00  0.00    -0.446 OA
ATOM     25  C   LIG    1        6.369  -2.280   0.215  0.00  0.00    +0.308 A 
ATOM     26  N   LIG    1        6.317  -2.235   1.527  0.00  0.00    -0.224 NA
ATOM     27  C   LIG    1        6.058  -0.914   1.795  0.00  0.00    +0.157 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   6  20
BRANCH   7  28
ATOM     28  C   LIG    1        3.121   1.281   1.923  0.00  0.00    +0.103 C 
ATOM     29  N   LIG    1        3.580   1.376   2.985  0.00  0.00    -0.191 NA
ENDBRANCH   7  28
TORSDOF 7