REMARK  Name = BDB055486
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.396  -0.932  -0.276  0.00  0.00    +0.127 A 
ATOM      2  N   LIG    1       -1.459  -2.230  -0.620  0.00  0.00    -0.200 NA
ATOM      3  C   LIG    1       -0.319  -2.904  -0.775  0.00  0.00    +0.215 A 
ATOM      4  N   LIG    1        0.897  -2.407  -0.575  0.00  0.00    -0.215 NA
ATOM      5  C   LIG    1        0.970  -1.111  -0.219  0.00  0.00    +0.078 A 
ATOM      6  C   LIG    1       -0.166  -0.340  -0.051  0.00  0.00    +0.072 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1        2.334  -0.580  -0.005  0.00  0.00    +0.003 A 
ATOM      8  C   LIG    1        2.674   0.742  -0.365  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        3.984   1.182  -0.132  0.00  0.00    +0.068 A 
ATOM     10  C   LIG    1        4.967   0.380   0.434  0.00  0.00    +0.041 A 
ATOM     11  C   LIG    1        6.119   1.208   0.487  0.00  0.00    +0.146 A 
ATOM     12  N   LIG    1        5.893   2.421  -0.007  0.00  0.00    -0.158 NA
ATOM     13  C   LIG    1        4.639  -0.939   0.791  0.00  0.00    +0.014 A 
ATOM     14  N   LIG    1        4.601   2.381  -0.369  0.00  0.00    -0.275 N 
ATOM     15  H   LIG    1        4.195   3.214  -0.779  0.00  0.00    +0.189 HD
ATOM     16  C   LIG    1        3.332  -1.397   0.561  0.00  0.00    +0.011 A 
BRANCH  11  17
ATOM     17  N   LIG    1        7.315   0.824   0.961  0.00  0.00    -0.341 N 
ATOM     18  H   LIG    1        7.558  -0.158   0.951  0.00  0.00    +0.144 HD
ATOM     19  H   LIG    1        8.091   1.429   0.714  0.00  0.00    +0.144 HD
ENDBRANCH  11  17
ENDBRANCH   5   7
BRANCH   1  22
ATOM     20  C   LIG    1       -2.655   2.142   0.603  0.00  0.00    +0.028 C 
ATOM     21  C   LIG    1       -2.642   1.179  -0.589  0.00  0.00    +0.072 C 
ATOM     22  N   LIG    1       -2.591  -0.214  -0.098  0.00  0.00    -0.312 N 
ATOM     23  C   LIG    1       -3.805  -1.034  -0.249  0.00  0.00    +0.107 C 
ATOM     24  C   LIG    1       -5.048  -0.210   0.071  0.00  0.00    +0.019 C 
ATOM     25  C   LIG    1       -5.183   1.004  -0.845  0.00  0.00    +0.003 C 
ATOM     26  C   LIG    1       -3.860   1.396  -1.500  0.00  0.00    +0.022 C 
ENDBRANCH   1  22
BRANCH   3  27
ATOM     27  N   LIG    1       -0.411  -4.238  -1.120  0.00  0.00    -0.327 N 
ATOM     28  H   LIG    1        0.415  -4.725  -0.803  0.00  0.00    +0.145 HD
ATOM     29  H   LIG    1       -1.307  -4.599  -0.825  0.00  0.00    +0.145 HD
ENDBRANCH   3  27
TORSDOF 4