REMARK  Name = BDB009146
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.416  -1.994  -0.587  0.00  0.00    -0.044 A 
ATOM      2  C   LIG    1        1.286  -1.186   0.165  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1        2.655  -1.088  -0.142  0.00  0.00    -0.018 A 
ATOM      4  C   LIG    1        3.141  -1.825  -1.232  0.00  0.00    +0.008 A 
ATOM      5  C   LIG    1        2.291  -2.636  -1.986  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        0.937  -2.720  -1.665  0.00  0.00    +0.004 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1        3.553  -0.235   0.656  0.00  0.00    -0.017 A 
ATOM      8  C   LIG    1        4.366   0.733   0.044  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1        5.220   1.548   0.800  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1        5.284   1.386   2.188  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1        4.484   0.430   2.812  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        3.625  -0.369   2.053  0.00  0.00    +0.008 A 
BRANCH   9  13
ATOM     13  C   LIG    1        6.053   2.550   0.082  0.00  0.00    +0.242 C 
ATOM     14  O   LIG    1        6.296   2.447  -1.113  0.00  0.00    -0.270 OA
ATOM     15  N   LIG    1        6.511   3.621   0.798  0.00  0.00    -0.325 N 
ATOM     16  H   LIG    1        6.106   3.889   1.683  0.00  0.00    +0.145 HD
ATOM     17  H   LIG    1        6.963   4.348   0.257  0.00  0.00    +0.145 HD
ENDBRANCH   9  13
ENDBRANCH   3   7
BRANCH   1  19
ATOM     18  C   LIG    1       -1.452  -3.466   0.224  0.00  0.00    +0.013 C 
ATOM     19  C   LIG    1       -1.060  -2.053  -0.226  0.00  0.00    +0.022 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.927  -1.560  -1.399  0.00  0.00    +0.065 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -3.300  -1.106  -0.922  0.00  0.00    +0.066 A 
ATOM     22  C   LIG    1       -3.478   0.285  -0.399  0.00  0.00    -0.016 A 
ATOM     23  C   LIG    1       -2.348   1.277  -0.430  0.00  0.00    +0.037 C 
ATOM     24  C   LIG    1       -2.787   2.713  -0.124  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -3.782   2.755   1.029  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1       -5.024   1.922   0.708  0.00  0.00    +0.041 C 
ATOM     27  C   LIG    1       -4.691   0.591   0.093  0.00  0.00    +0.023 A 
ATOM     28  C   LIG    1       -5.788  -0.409   0.047  0.00  0.00    +0.268 A 
ATOM     29  O   LIG    1       -6.910  -0.158   0.474  0.00  0.00    -0.266 OA
ATOM     30  N   LIG    1       -5.471  -1.619  -0.507  0.00  0.00    -0.243 N 
ATOM     31  H   LIG    1       -6.205  -2.319  -0.546  0.00  0.00    +0.192 HD
ATOM     32  N   LIG    1       -4.249  -1.991  -0.971  0.00  0.00    -0.176 NA
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 5