REMARK  Name = BDB060564
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.944  -1.166  -0.047  0.00  0.00    +0.014 A 
ATOM      2  C   LIG    1       -0.445  -1.349   0.096  0.00  0.00    +0.125 A 
ATOM      3  C   LIG    1       -0.984  -2.639   0.037  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1       -0.159  -3.744  -0.183  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        1.212  -3.571  -0.331  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        1.762  -2.292  -0.257  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1        1.575   0.206   0.051  0.00  0.00    +0.162 C 
BRANCH   7   9
ATOM      8  C   LIG    1        3.629   0.675  -1.372  0.00  0.00    +0.141 A 
ATOM      9  N   LIG    1        2.259   0.599  -1.179  0.00  0.00    -0.323 N 
ATOM     10  C   LIG    1        1.649   0.975  -2.361  0.00  0.00    +0.036 A 
ATOM     11  C   LIG    1        0.185   1.079  -2.568  0.00  0.00    +0.065 C 
ATOM     12  C   LIG    1        2.688   1.184  -3.238  0.00  0.00    +0.134 A 
ATOM     13  N   LIG    1        3.893   0.983  -2.629  0.00  0.00    -0.236 NA
BRANCH   8  18
ATOM     14  C   LIG    1        7.726  -0.390   2.560  0.00  0.00    +0.044 C 
ATOM     15  C   LIG    1        6.643  -0.127   1.557  0.00  0.00    -0.050 A 
ATOM     16  C   LIG    1        6.553  -0.899   0.393  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        5.567  -0.629  -0.560  0.00  0.00    +0.012 A 
ATOM     18  C   LIG    1        4.653   0.411  -0.362  0.00  0.00    +0.017 A 
ATOM     19  C   LIG    1        4.768   1.208   0.782  0.00  0.00    +0.012 A 
ATOM     20  C   LIG    1        5.755   0.940   1.736  0.00  0.00    +0.004 A 
ENDBRANCH   8  18
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   2  21
ATOM     21  O   LIG    1       -1.183  -0.219   0.331  0.00  0.00    -0.492 OA
BRANCH  21  22
ATOM     22  C   LIG    1       -2.577  -0.242   0.016  0.00  0.00    +0.229 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.393  -0.441   1.291  0.00  0.00    +0.041 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.899  -0.577   1.048  0.00  0.00    +0.007 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -5.573   0.591   0.299  0.00  0.00    -0.003 C 
ATOM     26  C   LIG    1       -7.051   0.248   0.066  0.00  0.00    +0.008 C 
BRANCH  25  27
ATOM     27  C   LIG    1       -5.440   1.918   1.062  0.00  0.00    +0.123 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -5.930   3.094   0.261  0.00  0.00    +0.305 C 
ATOM     29  O   LIG    1       -6.898   3.788   0.519  0.00  0.00    -0.251 OA
BRANCH  28  30
ATOM     30  O   LIG    1       -5.166   3.346  -0.818  0.00  0.00    -0.481 OA
ATOM     31  H   LIG    1       -5.588   4.130  -1.229  0.00  0.00    +0.295 HD
ENDBRANCH  28  30
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH   2  21
TORSDOF 11