REMARK  Name = BDB032466
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.473  -0.333   1.044  0.00  0.00    -0.024 A 
ATOM      2  C   LIG    1       -0.236   0.313   0.025  0.00  0.00    +0.072 A 
ATOM      3  C   LIG    1       -1.505   0.798   0.299  0.00  0.00    +0.215 A 
ATOM      4  N   LIG    1       -2.108   0.676   1.498  0.00  0.00    -0.221 NA
ATOM      5  C   LIG    1       -1.407   0.057   2.471  0.00  0.00    +0.115 A 
ATOM      6  C   LIG    1       -0.131  -0.456   2.297  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1        1.863  -0.860   0.790  0.00  0.00    +0.137 C 
BRANCH   7   8
ATOM      8  N   LIG    1        2.775   0.261   0.617  0.00  0.00    -0.340 N 
ATOM      9  H   LIG    1        2.568   1.033   1.246  0.00  0.00    +0.146 HD
BRANCH   8  14
ATOM     10  C   LIG    1        8.353  -0.490  -0.067  0.00  0.00    +0.124 A 
ATOM     11  C   LIG    1        6.967  -0.263   0.122  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        6.093  -1.347  -0.096  0.00  0.00    -0.011 A 
ATOM     13  C   LIG    1        4.703  -1.181   0.079  0.00  0.00    +0.031 A 
ATOM     14  C   LIG    1        4.148   0.034   0.498  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1        5.018   1.114   0.671  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1        6.625  -2.578  -0.491  0.00  0.00    +0.028 A 
ATOM     17  C   LIG    1        7.994  -2.691  -0.647  0.00  0.00    +0.113 A 
ATOM     18  C   LIG    1        6.400   0.973   0.502  0.00  0.00    +0.014 A 
ATOM     19  N   LIG    1        8.858  -1.679  -0.442  0.00  0.00    -0.240 NA
BRANCH  10  20
ATOM     20  N   LIG    1        9.292   0.536   0.125  0.00  0.00    -0.343 N 
ATOM     21  H   LIG    1        9.085   1.299  -0.512  0.00  0.00    +0.144 HD
ATOM     22  H   LIG    1        9.223   0.878   1.077  0.00  0.00    +0.144 HD
ENDBRANCH  10  20
ENDBRANCH   8  14
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   3  23
ATOM     23  O   LIG    1       -2.162   1.412  -0.748  0.00  0.00    -0.476 OA
BRANCH  23  24
ATOM     24  C   LIG    1       -3.424   1.992  -0.406  0.00  0.00    +0.234 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.564   0.968  -0.505  0.00  0.00    +0.035 C 
ATOM     26  C   LIG    1       -5.894   1.621  -0.095  0.00  0.00    +0.081 C 
ATOM     27  C   LIG    1       -7.066   0.761  -0.426  0.00  0.00    +0.110 A 
ATOM     28  N   LIG    1       -6.983  -0.271  -1.325  0.00  0.00    -0.334 N 
ATOM     29  C   LIG    1       -8.217  -0.838  -1.441  0.00  0.00    +0.107 A 
ATOM     30  C   LIG    1       -9.016  -0.108  -0.592  0.00  0.00    +0.130 A 
ATOM     31  C   LIG    1       -5.764  -0.695  -1.980  0.00  0.00    +0.123 C 
ATOM     32  N   LIG    1       -8.296   0.881   0.030  0.00  0.00    -0.241 NA
ATOM     33  C   LIG    1       -4.672   0.374  -1.923  0.00  0.00    +0.029 C 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   3  23
TORSDOF 7