REMARK  Name = BDB032427
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.927   1.247  -0.451  0.00  0.00    +0.215 A 
ATOM      2  N   LIG    1        1.032   2.311  -1.274  0.00  0.00    -0.221 NA
ATOM      3  C   LIG    1       -0.091   3.033  -1.474  0.00  0.00    +0.115 A 
ATOM      4  C   LIG    1       -1.311   2.742  -0.885  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1       -1.398   1.639  -0.030  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1       -0.248   0.874   0.183  0.00  0.00    +0.072 A 
ENDROOT
BRANCH   1   7
ATOM      7  O   LIG    1        2.029   0.454  -0.200  0.00  0.00    -0.476 OA
BRANCH   7   8
ATOM      8  C   LIG    1        3.209   0.892  -0.882  0.00  0.00    +0.235 C 
BRANCH   8  13
ATOM      9  C   LIG    1        8.099  -1.089   0.880  0.00  0.00    +0.104 C 
ATOM     10  N   LIG    1        6.816  -1.464   0.301  0.00  0.00    -0.305 NA
ATOM     11  C   LIG    1        6.619  -0.957  -1.064  0.00  0.00    +0.088 C 
ATOM     12  C   LIG    1        5.677   0.259  -1.206  0.00  0.00    +0.010 C 
ATOM     13  C   LIG    1        4.342  -0.084  -0.537  0.00  0.00    +0.035 C 
ATOM     14  C   LIG    1        4.796  -0.026   0.928  0.00  0.00    +0.010 C 
ATOM     15  C   LIG    1        5.608   1.277   1.005  0.00  0.00    +0.005 C 
ATOM     16  C   LIG    1        6.186   1.466  -0.403  0.00  0.00    +0.005 C 
ATOM     17  C   LIG    1        5.680  -1.261   1.211  0.00  0.00    +0.088 C 
ENDBRANCH   8  13
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   5  18
ATOM     18  C   LIG    1       -2.707   1.276   0.623  0.00  0.00    +0.137 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -3.632   0.802  -0.397  0.00  0.00    -0.340 N 
ATOM     20  H   LIG    1       -3.176   0.203  -1.082  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -4.885   0.307  -0.023  0.00  0.00    +0.028 A 
ATOM     22  C   LIG    1       -5.616  -0.437  -0.963  0.00  0.00    +0.031 A 
ATOM     23  C   LIG    1       -6.913  -0.919  -0.695  0.00  0.00    -0.011 A 
ATOM     24  C   LIG    1       -7.519  -0.636   0.543  0.00  0.00    +0.022 A 
ATOM     25  C   LIG    1       -8.814  -1.151   0.766  0.00  0.00    +0.124 A 
ATOM     26  N   LIG    1       -9.498  -1.871  -0.143  0.00  0.00    -0.240 NA
ATOM     27  C   LIG    1       -8.891  -2.110  -1.322  0.00  0.00    +0.113 A 
ATOM     28  C   LIG    1       -6.804   0.154   1.468  0.00  0.00    +0.014 A 
ATOM     29  C   LIG    1       -7.619  -1.668  -1.641  0.00  0.00    +0.028 A 
ATOM     30  C   LIG    1       -5.517   0.626   1.180  0.00  0.00    +0.023 A 
BRANCH  25  31
ATOM     31  N   LIG    1       -9.494  -0.940   1.971  0.00  0.00    -0.343 N 
ATOM     32  H   LIG    1       -8.948  -1.286   2.751  0.00  0.00    +0.144 HD
ATOM     33  H   LIG    1      -10.376  -1.440   1.884  0.00  0.00    +0.144 HD
ENDBRANCH  25  31
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH   5  18
TORSDOF 7