REMARK  Name = BDB051765
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.844  -2.216   0.191  0.00  0.00    -0.394 OA
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1       -0.790  -1.454  -0.988  0.00  0.00    -0.089 NA
ATOM      3  C   LIG    1       -1.929  -0.882  -1.244  0.00  0.00    +0.088 C 
BRANCH   3   4
ATOM      4  C   LIG    1       -3.174  -1.058  -0.458  0.00  0.00    -0.001 A 
ATOM      5  C   LIG    1       -3.736  -2.333  -0.323  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -4.920  -2.491   0.395  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -5.540  -1.379   0.970  0.00  0.00    +0.000 A 
ATOM      8  C   LIG    1       -4.976  -0.108   0.833  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -3.792   0.055   0.115  0.00  0.00    +0.010 A 
ENDBRANCH   3   4
BRANCH   3  10
ATOM     10  C   LIG    1       -2.005   0.077  -2.419  0.00  0.00    +0.070 C 
BRANCH  10  11
ATOM     11  C   LIG    1       -1.346  -0.509  -3.664  0.00  0.00    +0.127 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -1.583   0.369  -4.858  0.00  0.00    +0.305 C 
ATOM     13  O   LIG    1       -2.081   1.480  -4.869  0.00  0.00    -0.251 OA
BRANCH  12  14
ATOM     14  O   LIG    1       -1.160  -0.204  -6.000  0.00  0.00    -0.481 OA
ATOM     15  H   LIG    1       -1.365   0.457  -6.692  0.00  0.00    +0.295 HD
ENDBRANCH  12  14
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   3  10
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  C   LIG    1        0.472  -2.651   0.525  0.00  0.00    +0.263 C 
BRANCH  16  17
ATOM     17  C   LIG    1        0.494  -3.095   1.987  0.00  0.00    +0.047 C 
BRANCH  17  18
ATOM     18  C   LIG    1        0.071  -2.020   3.000  0.00  0.00    +0.047 C 
BRANCH  18  19
ATOM     19  C   LIG    1        1.079  -0.888   3.159  0.00  0.00    +0.263 C 
BRANCH  19  20
ATOM     20  O   LIG    1        1.051  -0.042   2.013  0.00  0.00    -0.394 OA
BRANCH  20  23
ATOM     21  C   LIG    1        1.300   1.380  -0.205  0.00  0.00    +0.069 C 
ATOM     22  C   LIG    1        2.297   1.465   0.934  0.00  0.00    +0.084 C 
ATOM     23  N   LIG    1        2.181   0.786   2.039  0.00  0.00    -0.089 NA
BRANCH  22  24
ATOM     24  C   LIG    1        3.477   2.363   0.767  0.00  0.00    -0.001 A 
ATOM     25  C   LIG    1        4.010   3.004   1.891  0.00  0.00    +0.010 A 
ATOM     26  C   LIG    1        5.116   3.848   1.760  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        5.695   4.050   0.506  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        5.169   3.411  -0.615  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        4.064   2.564  -0.487  0.00  0.00    +0.010 A 
ENDBRANCH  22  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 13