REMARK  Name = BDB003267
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.109   1.594   0.914  0.00  0.00    -0.272 OA
ATOM      2  C   LIG    1       -0.628   0.781   1.680  0.00  0.00    +0.249 C 
ATOM      3  N   LIG    1       -0.029  -0.396   2.135  0.00  0.00    -0.206 N 
ATOM      4  H   LIG    1       -0.390  -0.813   2.986  0.00  0.00    +0.177 HD
ENDROOT
BRANCH   3   5
ATOM      5  N   LIG    1        1.279  -0.734   1.897  0.00  0.00    -0.188 NA
ATOM      6  C   LIG    1        1.720  -0.553   0.691  0.00  0.00    +0.142 C 
BRANCH   6   7
ATOM      7  C   LIG    1        3.129  -0.798   0.322  0.00  0.00    +0.044 A 
ATOM      8  C   LIG    1        3.837   0.201  -0.402  0.00  0.00    -0.006 A 
ATOM      9  C   LIG    1        5.179  -0.068  -0.769  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1        5.917   0.889  -1.487  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1        5.352   2.114  -1.841  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.044   2.400  -1.478  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        5.773  -1.289  -0.411  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1        5.062  -2.256   0.299  0.00  0.00    +0.046 A 
ATOM     15  C   LIG    1        3.296   1.459  -0.766  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1        3.741  -2.013   0.660  0.00  0.00    +0.126 A 
BRANCH  16  17
ATOM     17  O   LIG    1        3.038  -2.993   1.304  0.00  0.00    -0.506 OA
ATOM     18  H   LIG    1        3.643  -3.700   1.577  0.00  0.00    +0.292 HD
ENDBRANCH  16  17
ENDBRANCH   6   7
ENDBRANCH   3   5
BRANCH   2  19
ATOM     19  C   LIG    1       -2.037   0.995   2.257  0.00  0.00    +0.202 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -3.096   0.946   1.229  0.00  0.00    -0.321 N 
ATOM     21  C   LIG    1       -3.491  -0.272   0.660  0.00  0.00    +0.033 A 
ATOM     22  C   LIG    1       -4.239  -0.302  -0.541  0.00  0.00    -0.026 A 
ATOM     23  C   LIG    1       -4.633  -1.524  -1.120  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1       -4.330  -2.731  -0.503  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -3.636  -2.724   0.697  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1       -4.603   0.968  -1.269  0.00  0.00    +0.038 C 
ATOM     27  C   LIG    1       -4.499   2.180  -0.361  0.00  0.00    +0.024 C 
ATOM     28  C   LIG    1       -3.232  -1.511   1.270  0.00  0.00    +0.023 A 
ATOM     29  C   LIG    1       -3.164   2.131   0.361  0.00  0.00    +0.106 C 
ENDBRANCH  19  20
ENDBRANCH   2  19
TORSDOF 5