REMARK  Name = BDB064740
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.764   1.368  -1.342  0.00  0.00    -0.014 A 
ATOM      2  C   LIG    1        0.359   1.933  -0.696  0.00  0.00    -0.018 A 
ATOM      3  C   LIG    1        0.728   3.257  -0.985  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        0.010   4.012  -1.914  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1       -1.083   3.442  -2.555  0.00  0.00    +0.117 A 
ATOM      6  C   LIG    1       -1.472   2.134  -2.281  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1       -2.414  -0.388  -0.766  0.00  0.00    +0.068 C 
ATOM      8  C   LIG    1       -1.163  -0.026  -1.086  0.00  0.00    +0.014 C 
BRANCH   7  11
ATOM      9  C   LIG    1       -5.051  -1.494  -1.285  0.00  0.00    +0.132 C 
ATOM     10  N   LIG    1       -3.991  -2.255  -0.639  0.00  0.00    -0.304 N 
ATOM     11  C   LIG    1       -2.694  -1.810  -0.433  0.00  0.00    +0.239 C 
ATOM     12  O   LIG    1       -1.798  -2.519   0.024  0.00  0.00    -0.271 OA
ATOM     13  C   LIG    1       -4.363  -3.569  -0.142  0.00  0.00    +0.132 C 
ENDBRANCH   7  11
ENDBRANCH   1   8
BRANCH   2  14
ATOM     14  C   LIG    1        1.110   1.174   0.317  0.00  0.00    +0.009 C 
ATOM     15  C   LIG    1        2.438   0.984   0.262  0.00  0.00    +0.009 C 
BRANCH  15  16
ATOM     16  C   LIG    1        3.166   0.164   1.239  0.00  0.00    -0.018 A 
ATOM     17  C   LIG    1        4.420   0.591   1.690  0.00  0.00    +0.053 A 
ATOM     18  C   LIG    1        5.139  -0.188   2.595  0.00  0.00    +0.121 A 
ATOM     19  C   LIG    1        4.635  -1.399   3.055  0.00  0.00    +0.090 A 
ATOM     20  C   LIG    1        3.398  -1.830   2.592  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1        2.662  -1.067   1.688  0.00  0.00    +0.053 A 
BRANCH  18  22
ATOM     22  O   LIG    1        6.352   0.279   3.010  0.00  0.00    -0.507 OA
ATOM     23  H   LIG    1        6.731  -0.365   3.632  0.00  0.00    +0.292 HD
ENDBRANCH  18  22
BRANCH  20  24
ATOM     24  O   LIG    1        2.932  -3.029   3.048  0.00  0.00    -0.507 OA
ATOM     25  H   LIG    1        2.070  -3.204   2.632  0.00  0.00    +0.292 HD
ENDBRANCH  20  24
ENDBRANCH  15  16
ENDBRANCH   2  14
BRANCH   5  26
ATOM     26  O   LIG    1       -1.811   4.140  -3.473  0.00  0.00    -0.507 OA
ATOM     27  H   LIG    1       -1.416   5.021  -3.579  0.00  0.00    +0.292 HD
ENDBRANCH   5  26
TORSDOF 7