REMARK  Name = BDB064449
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.813  -0.379  -1.617  0.00  0.00    +0.217 A 
ATOM      2  N   LIG    1        2.114   0.877  -1.960  0.00  0.00    -0.214 NA
ATOM      3  C   LIG    1        1.234   1.833  -1.655  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        0.026   1.572  -1.006  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1       -0.848   2.648  -0.692  0.00  0.00    +0.022 A 
ATOM      6  C   LIG    1       -0.542   3.973  -1.032  0.00  0.00    -0.017 A 
ATOM      7  C   LIG    1        0.668   4.204  -1.693  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1       -0.209   0.221  -0.707  0.00  0.00    +0.132 A 
ATOM      9  C   LIG    1        1.534   3.145  -1.992  0.00  0.00    +0.029 A 
ATOM     10  N   LIG    1        0.685  -0.737  -1.001  0.00  0.00    -0.199 NA
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1       -1.456   5.077  -0.701  0.00  0.00    -0.018 A 
ATOM     12  C   LIG    1       -1.009   6.194   0.025  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1       -1.877   7.243   0.340  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -3.207   7.193  -0.068  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1       -3.671   6.096  -0.789  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -2.802   5.047  -1.102  0.00  0.00    +0.008 A 
ENDBRANCH   6  11
BRANCH   1  17
ATOM     17  N   LIG    1        2.694  -1.413  -1.903  0.00  0.00    -0.313 N 
ATOM     18  H   LIG    1        2.418  -2.189  -1.295  0.00  0.00    +0.149 HD
BRANCH  17  19
ATOM     19  C   LIG    1        4.094  -1.062  -1.741  0.00  0.00    +0.105 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.963  -2.324  -1.799  0.00  0.00    +0.034 C 
BRANCH  20  21
ATOM     21  C   LIG    1        4.820  -3.226  -0.566  0.00  0.00    +0.082 C 
BRANCH  21  23
ATOM     22  C   LIG    1        3.349  -4.640   0.719  0.00  0.00    +0.101 C 
ATOM     23  N   LIG    1        3.482  -3.819  -0.478  0.00  0.00    -0.319 NA
ATOM     24  H   LIG    1        3.320  -4.401  -1.303  0.00  0.00    +0.122 HD
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   1  17
BRANCH   8  25
ATOM     25  N   LIG    1       -1.413  -0.145  -0.055  0.00  0.00    -0.328 N 
ATOM     26  H   LIG    1       -2.187   0.206  -0.613  0.00  0.00    +0.147 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.547  -1.579   0.210  0.00  0.00    +0.106 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -2.858  -1.843   0.979  0.00  0.00    +0.008 C 
ATOM     29  C   LIG    1       -2.849  -1.228   2.390  0.00  0.00    +0.020 C 
ATOM     30  C   LIG    1       -1.942  -1.994   3.353  0.00  0.00    +0.081 C 
ATOM     31  N   LIG    1       -2.296  -3.414   3.417  0.00  0.00    -0.316 NA
ATOM     32  H   LIG    1       -3.249  -3.499   3.771  0.00  0.00    +0.122 HD
ATOM     33  C   LIG    1       -2.220  -4.042   2.098  0.00  0.00    +0.081 C 
ATOM     34  C   LIG    1       -3.137  -3.351   1.088  0.00  0.00    +0.020 C 
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   8  25
TORSDOF 9