REMARK  Name = BDB028143
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.469   0.611  -0.033  0.00  0.00    +0.083 A 
ATOM      2  C   LIG    1       -3.414  -0.408  -0.265  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -3.772  -1.544  -0.983  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1       -2.832  -2.545  -1.239  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1       -1.524  -2.406  -0.771  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -1.134  -1.269  -0.043  0.00  0.00    -0.016 A 
ATOM      7  C   LIG    1       -5.154  -1.681  -1.472  0.00  0.00    +0.272 A 
ATOM      8  O   LIG    1       -5.510  -2.665  -2.109  0.00  0.00    -0.266 OA
ATOM      9  N   LIG    1       -6.005  -0.647  -1.171  0.00  0.00    -0.242 N 
ATOM     10  H   LIG    1       -6.963  -0.724  -1.499  0.00  0.00    +0.192 HD
ATOM     11  C   LIG    1       -2.098  -0.271   0.203  0.00  0.00    +0.019 A 
ATOM     12  N   LIG    1       -5.688   0.476  -0.471  0.00  0.00    -0.174 NA
ENDROOT
BRANCH   6  13
ATOM     13  C   LIG    1        0.244  -1.124   0.449  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        1.004   0.025   0.189  0.00  0.00    +0.057 A 
ATOM     15  C   LIG    1        2.312   0.128   0.662  0.00  0.00    +0.147 A 
ATOM     16  C   LIG    1        2.820  -0.918   1.420  0.00  0.00    +0.157 A 
ATOM     17  N   LIG    1        2.128  -2.047   1.696  0.00  0.00    -0.259 NA
ATOM     18  C   LIG    1        0.867  -2.121   1.204  0.00  0.00    +0.119 A 
BRANCH  15  19
ATOM     19  O   LIG    1        2.983   1.296   0.395  0.00  0.00    -0.454 OA
BRANCH  19  20
ATOM     20  C   LIG    1        4.334   1.208   0.156  0.00  0.00    +0.129 A 
ATOM     21  C   LIG    1        4.857   0.391  -0.850  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1        6.234   0.365  -1.071  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        7.080   1.164  -0.302  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        6.552   1.997   0.685  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1        5.175   2.026   0.909  0.00  0.00    +0.046 A 
ENDBRANCH  19  20
ENDBRANCH  15  19
ENDBRANCH   6  13
BRANCH   1  26
ATOM     26  C   LIG    1       -4.102   1.873   0.756  0.00  0.00    +0.136 C 
BRANCH  26  27
ATOM     27  N   LIG    1       -5.255   2.771   0.883  0.00  0.00    -0.325 NA
ATOM     28  H   LIG    1       -5.604   2.960  -0.060  0.00  0.00    +0.119 HD
ATOM     29  H   LIG    1       -6.018   2.234   1.304  0.00  0.00    +0.119 HD
ENDBRANCH  26  27
ENDBRANCH   1  26
TORSDOF 5