REMARK  Name = BDB014795
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.716   0.049   0.358  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -0.982   0.276   1.308  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -7.355   0.904   2.055  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -5.854   0.785   2.127  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -5.159   0.707   0.927  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -3.688   0.687   1.042  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -3.062   0.254  -0.234  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -1.708  -0.033  -0.563  0.00  0.00    +0.150 A 
ATOM      9  N   LIG    1       -1.605  -0.369  -1.854  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -2.858  -0.324  -2.336  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -3.087  -0.667  -3.719  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -3.764   0.068  -1.406  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -5.225   0.251  -1.554  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.736   1.108  -0.376  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -5.289   0.751   3.221  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        0.679  -0.158   0.259  0.00  0.00    +0.032 A 
ATOM     17  C   LIG    1        1.460  -0.042   1.420  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        2.848  -0.234   1.389  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1        3.507  -0.550   0.195  0.00  0.00    -0.018 A 
ATOM     20  C   LIG    1        2.728  -0.666  -0.964  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1        1.339  -0.472  -0.931  0.00  0.00    +0.024 A 
BRANCH  19  22
ATOM     22  C   LIG    1        4.964  -0.756   0.158  0.00  0.00    -0.018 A 
ATOM     23  C   LIG    1        5.846   0.217   0.662  0.00  0.00    +0.012 A 
ATOM     24  C   LIG    1        7.236   0.028   0.640  0.00  0.00    -0.050 A 
ATOM     25  C   LIG    1        8.154   1.099   1.150  0.00  0.00    +0.044 C 
ATOM     26  C   LIG    1        7.754  -1.145   0.083  0.00  0.00    +0.003 A 
ATOM     27  C   LIG    1        6.898  -2.121  -0.421  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1        5.515  -1.928  -0.382  0.00  0.00    +0.008 A 
ENDBRANCH  19  22
ENDBRANCH   1  16
TORSDOF 3