REMARK  Name = BDB063334
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.206  -0.584   1.728  0.00  0.00    +0.203 A 
ATOM      2  N   LIG    1        0.024  -0.033   2.120  0.00  0.00    -0.253 N 
ATOM      3  C   LIG    1        1.133   0.003   1.310  0.00  0.00    +0.173 A 
ATOM      4  N   LIG    1        2.120   0.597   1.951  0.00  0.00    -0.129 NA
ATOM      5  N   LIG    1        1.666   0.936   3.207  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        1.008  -0.565   0.013  0.00  0.00    +0.045 A 
ATOM      7  C   LIG    1       -0.197  -1.102  -0.280  0.00  0.00    +0.126 A 
ATOM      8  C   LIG    1        0.414   0.547   3.294  0.00  0.00    +0.232 A 
ATOM      9  N   LIG    1       -1.307  -1.118   0.541  0.00  0.00    -0.223 NA
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1        2.102  -0.643  -0.983  0.00  0.00    -0.012 A 
ATOM     11  C   LIG    1        1.905  -0.212  -2.309  0.00  0.00    +0.018 A 
ATOM     12  C   LIG    1        2.960  -0.298  -3.239  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        4.189  -0.799  -2.817  0.00  0.00    +0.046 A 
ATOM     14  N   LIG    1        5.035  -0.768  -3.902  0.00  0.00    -0.361 N 
ATOM     15  H   LIG    1        6.000  -1.069  -3.885  0.00  0.00    +0.165 HD
ATOM     16  C   LIG    1        4.382  -0.265  -4.996  0.00  0.00    +0.083 A 
ATOM     17  C   LIG    1        4.423  -1.219  -1.505  0.00  0.00    +0.027 A 
ATOM     18  C   LIG    1        3.093   0.034  -4.616  0.00  0.00    +0.027 A 
ATOM     19  C   LIG    1        3.359  -1.129  -0.599  0.00  0.00    +0.011 A 
ENDBRANCH   6  10
BRANCH   1  20
ATOM     20  N   LIG    1       -2.264  -0.552   2.612  0.00  0.00    -0.307 N 
ATOM     21  H   LIG    1       -2.223   0.124   3.368  0.00  0.00    +0.149 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -3.641  -0.720   2.166  0.00  0.00    +0.178 C 
BRANCH  22  25
ATOM     23  C   LIG    1       -5.681   2.374   1.873  0.00  0.00    +0.041 A 
ATOM     24  C   LIG    1       -5.263   1.163   1.272  0.00  0.00    +0.046 A 
ATOM     25  C   LIG    1       -4.411   0.557   2.171  0.00  0.00    +0.122 A 
ATOM     26  O   LIG    1       -4.273   1.341   3.281  0.00  0.00    -0.466 OA
ATOM     27  C   LIG    1       -5.055   2.434   3.095  0.00  0.00    +0.195 A 
ENDBRANCH  22  25
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 4