REMARK  Name = BDB017146
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.525  -0.756  -0.864  0.00  0.00    +0.018 A 
ATOM      2  C   LIG    1        1.139  -0.469   0.357  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1        2.541  -0.429   0.475  0.00  0.00    -0.017 A 
ATOM      4  C   LIG    1        3.369  -0.696  -0.644  0.00  0.00    -0.010 A 
ATOM      5  C   LIG    1        4.788  -0.654  -0.476  0.00  0.00    +0.016 A 
ATOM      6  C   LIG    1        5.344  -0.310   0.777  0.00  0.00    +0.125 A 
ATOM      7  C   LIG    1        4.507  -0.057   1.861  0.00  0.00    +0.046 A 
ATOM      8  C   LIG    1        2.720  -0.985  -1.867  0.00  0.00    +0.009 A 
ATOM      9  C   LIG    1        3.123  -0.121   1.710  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1        1.326  -1.020  -1.974  0.00  0.00    +0.012 A 
ENDROOT
BRANCH   1  11
ATOM     11  C   LIG    1       -0.960  -0.814  -1.034  0.00  0.00    +0.167 C 
ATOM     12  O   LIG    1       -1.407  -1.450  -1.988  0.00  0.00    -0.292 OA
BRANCH  11  15
ATOM     13  N   LIG    1       -4.313   0.480   0.344  0.00  0.00    -0.302 NA
ATOM     14  C   LIG    1       -3.353  -0.454  -0.282  0.00  0.00    +0.095 C 
ATOM     15  C   LIG    1       -1.867  -0.110  -0.024  0.00  0.00    +0.074 C 
ATOM     16  C   LIG    1       -1.689   1.408  -0.055  0.00  0.00    +0.014 C 
ATOM     17  C   LIG    1       -2.573   2.082   1.000  0.00  0.00    +0.016 C 
ATOM     18  C   LIG    1       -3.736   1.204   1.474  0.00  0.00    +0.084 C 
BRANCH  13  19
ATOM     19  C   LIG    1       -5.582  -0.168   0.697  0.00  0.00    +0.084 C 
BRANCH  19  21
ATOM     20  C   LIG    1       -6.734   0.345  -1.521  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1       -6.360  -0.724  -0.505  0.00  0.00    +0.012 C 
ENDBRANCH  19  21
ENDBRANCH  13  19
ENDBRANCH  11  15
ENDBRANCH   1  11
BRANCH   6  22
ATOM     22  O   LIG    1        6.713  -0.260   0.834  0.00  0.00    -0.495 OA
ATOM     23  C   LIG    1        7.306   0.254   2.021  0.00  0.00    +0.277 C 
ENDBRANCH   6  22
BRANCH   5  24
ATOM     24  C   LIG    1        5.731  -0.932  -1.637  0.00  0.00    +0.157 C 
BRANCH  24  25
ATOM     25  C   LIG    1        5.994   0.268  -2.446  0.00  0.00    +0.067 C 
ATOM     26  N   LIG    1        6.201   1.200  -3.107  0.00  0.00    -0.196 NA
ENDBRANCH  24  25
ENDBRANCH   5  24
TORSDOF 7