REMARK  Name = BDB008756
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.900   0.026   0.748  0.00  0.00    +0.127 A 
ATOM      2  N   LIG    1        0.014  -0.412  -0.139  0.00  0.00    -0.224 NA
ATOM      3  C   LIG    1        1.157   0.293  -0.246  0.00  0.00    +0.116 A 
ATOM      4  C   LIG    1        1.446   1.425   0.498  0.00  0.00    +0.045 A 
ATOM      5  C   LIG    1        0.502   1.875   1.425  0.00  0.00    -0.012 A 
ATOM      6  C   LIG    1       -0.693   1.147   1.542  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1        0.750   3.071   2.248  0.00  0.00    -0.015 A 
ATOM      8  C   LIG    1       -0.209   4.085   2.363  0.00  0.00    +0.028 A 
ATOM      9  C   LIG    1        0.070   5.194   3.146  0.00  0.00    +0.111 A 
ATOM     10  N   LIG    1        1.226   5.367   3.819  0.00  0.00    -0.263 NA
ATOM     11  C   LIG    1        2.141   4.382   3.706  0.00  0.00    +0.111 A 
ATOM     12  C   LIG    1        1.953   3.238   2.946  0.00  0.00    +0.028 A 
ENDBRANCH   5   7
BRANCH   1  14
ATOM     13  C   LIG    1       -3.222  -0.544   1.489  0.00  0.00    +0.235 C 
ATOM     14  N   LIG    1       -2.051  -0.754   0.796  0.00  0.00    -0.269 N 
ATOM     15  H   LIG    1       -2.060  -1.534   0.144  0.00  0.00    +0.156 HD
ATOM     16  O   LIG    1       -3.459   0.409   2.226  0.00  0.00    -0.274 OA
BRANCH  13  17
ATOM     17  C   LIG    1       -4.224  -1.712   1.287  0.00  0.00    +0.137 C 
ATOM     18  C   LIG    1       -5.647  -1.255   1.605  0.00  0.00    +0.034 C 
BRANCH  17  20
ATOM     19  C   LIG    1       -4.664  -3.556  -0.257  0.00  0.00    +0.101 C 
ATOM     20  N   LIG    1       -4.089  -2.226  -0.100  0.00  0.00    -0.309 NA
ATOM     21  H   LIG    1       -4.556  -1.580  -0.739  0.00  0.00    +0.122 HD
ENDBRANCH  17  20
ENDBRANCH  13  17
ENDBRANCH   1  14
BRANCH   3  22
ATOM     22  C   LIG    1        2.083  -0.212  -1.208  0.00  0.00    -0.041 C 
ATOM     23  C   LIG    1        2.861  -0.636  -2.020  0.00  0.00    -0.060 C 
BRANCH  23  24
ATOM     24  C   LIG    1        3.779  -1.143  -2.991  0.00  0.00    +0.025 A 
ATOM     25  C   LIG    1        3.307  -1.881  -4.079  0.00  0.00    +0.017 A 
ATOM     26  C   LIG    1        4.203  -2.376  -5.029  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        5.569  -2.134  -4.893  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        6.043  -1.398  -3.807  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        5.148  -0.902  -2.856  0.00  0.00    +0.017 A 
ENDBRANCH  23  24
ENDBRANCH   3  22
TORSDOF 6