REMARK  Name = BDB028268
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.191  -1.279   0.287  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -1.121  -0.302   0.694  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -2.497  -0.573   0.711  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -2.952  -1.823   0.306  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -4.399  -2.093   0.295  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -5.210  -1.057   0.687  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -6.212  -1.224   0.683  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -4.798   0.170   1.105  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -4.843  -3.183  -0.048  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -2.049  -2.810  -0.100  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -3.520   0.416   1.135  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1       -0.679  -2.537  -0.105  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  19
ATOM     13  C   LIG    1        3.625   2.581  -1.683  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1        4.019   1.386  -0.892  0.00  0.00    -0.024 A 
ATOM     15  C   LIG    1        3.142   0.386  -0.367  0.00  0.00    +0.022 A 
ATOM     16  C   LIG    1        3.931  -0.544   0.299  0.00  0.00    +0.138 A 
ATOM     17  N   LIG    1        3.527  -1.653   0.942  0.00  0.00    -0.237 NA
ATOM     18  C   LIG    1        2.181  -1.821   0.894  0.00  0.00    +0.121 A 
ATOM     19  C   LIG    1        1.250  -0.984   0.267  0.00  0.00    +0.001 A 
ATOM     20  N   LIG    1        5.232  -0.141   0.195  0.00  0.00    -0.346 N 
ATOM     21  H   LIG    1        6.007  -0.648   0.597  0.00  0.00    +0.167 HD
ATOM     22  C   LIG    1        1.755   0.155  -0.382  0.00  0.00    +0.021 A 
ATOM     23  C   LIG    1        5.303   1.025  -0.522  0.00  0.00    +0.088 A 
ENDBRANCH   1  19
BRANCH  11  24
ATOM     24  C   LIG    1       -3.088   1.795   1.626  0.00  0.00    +0.136 C 
BRANCH  24  25
ATOM     25  N   LIG    1       -2.738   2.629   0.474  0.00  0.00    -0.325 NA
ATOM     26  H   LIG    1       -3.562   2.698  -0.129  0.00  0.00    +0.119 HD
ATOM     27  H   LIG    1       -2.563   3.579   0.799  0.00  0.00    +0.119 HD
ENDBRANCH  24  25
ENDBRANCH  11  24
TORSDOF 3