REMARK  Name = BDB059223
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.934   3.619   0.721  0.00  0.00    +0.019 A 
ATOM      2  C   LIG    1        0.511   2.333   0.445  0.00  0.00    +0.163 A 
ATOM      3  N   LIG    1        1.650   1.527   0.454  0.00  0.00    -0.200 N 
ATOM      4  C   LIG    1        1.572   0.137   0.193  0.00  0.00    +0.126 A 
ATOM      5  C   LIG    1        0.358  -0.383  -0.058  0.00  0.00    +0.087 A 
ATOM      6  C   LIG    1       -0.826   0.539  -0.035  0.00  0.00    +0.124 A 
ATOM      7  N   LIG    1        2.778   2.254   0.707  0.00  0.00    -0.171 NA
ATOM      8  N   LIG    1       -0.733   1.827   0.198  0.00  0.00    -0.213 NA
ATOM      9  C   LIG    1        2.333   3.498   0.872  0.00  0.00    +0.141 A 
ENDROOT
BRANCH   1  11
ATOM     10  C   LIG    1        0.466   5.889  -0.232  0.00  0.00    +0.012 C 
ATOM     11  C   LIG    1        0.090   4.853   0.829  0.00  0.00    +0.018 C 
ATOM     12  C   LIG    1        0.165   5.467   2.228  0.00  0.00    +0.012 C 
ENDBRANCH   1  11
BRANCH   6  13
ATOM     13  N   LIG    1       -2.104   0.084  -0.266  0.00  0.00    -0.329 N 
ATOM     14  H   LIG    1       -2.759   0.845  -0.101  0.00  0.00    +0.147 HD
BRANCH  13  15
ATOM     15  C   LIG    1       -2.590  -1.209   0.180  0.00  0.00    +0.106 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -4.063  -1.394  -0.210  0.00  0.00    +0.008 C 
ATOM     17  C   LIG    1       -4.260  -1.469  -1.730  0.00  0.00    +0.020 C 
ATOM     18  C   LIG    1       -5.743  -1.623  -2.085  0.00  0.00    +0.081 C 
ATOM     19  N   LIG    1       -6.520  -2.431  -1.139  0.00  0.00    -0.316 NA
ATOM     20  H   LIG    1       -6.980  -1.811  -0.471  0.00  0.00    +0.122 HD
ATOM     21  C   LIG    1       -5.681  -3.375  -0.411  0.00  0.00    +0.081 C 
ATOM     22  C   LIG    1       -4.649  -2.654   0.461  0.00  0.00    +0.020 C 
ENDBRANCH  15  16
ENDBRANCH  13  15
ENDBRANCH   6  13
BRANCH   4  23
ATOM     23  N   LIG    1        2.769  -0.585   0.218  0.00  0.00    -0.325 N 
ATOM     24  H   LIG    1        3.566   0.058   0.304  0.00  0.00    +0.148 HD
BRANCH  23  25
ATOM     25  C   LIG    1        3.057  -1.744  -0.605  0.00  0.00    +0.138 C 
BRANCH  25  26
ATOM     26  C   LIG    1        4.468  -2.213  -0.348  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        5.476  -2.009  -1.302  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1        6.781  -2.440  -1.055  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        7.092  -3.072   0.147  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        6.102  -3.271   1.107  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        4.797  -2.842   0.862  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH   4  23
TORSDOF 7