REMARK  Name = BDB050755
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.123  -1.554   1.169  0.00  0.00    +0.075 A 
ATOM      2  C   LIG    1        0.094  -2.251   2.369  0.00  0.00    +0.170 A 
ATOM      3  F   LIG    1        0.749  -3.412   2.513  0.00  0.00    -0.202 F 
ATOM      4  C   LIG    1       -0.596  -1.714   3.447  0.00  0.00    +0.159 A 
ATOM      5  F   LIG    1       -0.615  -2.358   4.622  0.00  0.00    -0.202 F 
ATOM      6  C   LIG    1       -1.268  -0.496   3.334  0.00  0.00    +0.045 A 
ATOM      7  C   LIG    1       -1.271   0.203   2.117  0.00  0.00    -0.038 A 
ATOM      8  C   LIG    1       -0.555  -0.332   1.034  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  13
ATOM      9  N   LIG    1        4.492  -0.334  -1.557  0.00  0.00    -0.300 NA
ATOM     10  C   LIG    1        3.411  -0.906  -2.389  0.00  0.00    +0.103 C 
ATOM     11  C   LIG    1        2.597  -1.996  -1.674  0.00  0.00    +0.123 C 
ATOM     12  N   LIG    1        1.950  -1.477  -0.468  0.00  0.00    -0.295 N 
ATOM     13  C   LIG    1        0.826  -2.131   0.015  0.00  0.00    +0.250 C 
ATOM     14  O   LIG    1        0.351  -3.144  -0.490  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        2.627  -0.353   0.190  0.00  0.00    +0.123 C 
ATOM     16  C   LIG    1        4.136  -0.307  -0.124  0.00  0.00    +0.103 C 
BRANCH   9  18
ATOM     17  C   LIG    1        6.307   1.362  -1.591  0.00  0.00    +0.020 C 
ATOM     18  C   LIG    1        4.919   0.967  -2.084  0.00  0.00    +0.081 C 
ENDBRANCH   9  18
ENDBRANCH   1  13
BRANCH   7  19
ATOM     19  C   LIG    1       -1.985   1.533   2.013  0.00  0.00    +0.093 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.734   1.734   0.702  0.00  0.00    +0.074 A 
ATOM     21  C   LIG    1       -4.040   1.063   0.479  0.00  0.00    +0.011 A 
ATOM     22  C   LIG    1       -4.667   1.286  -0.746  0.00  0.00    +0.050 A 
ATOM     23  C   LIG    1       -5.900   0.689  -1.036  0.00  0.00    +0.014 A 
ATOM     24  C   LIG    1       -6.507  -0.138  -0.094  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1       -5.885  -0.367   1.133  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1       -4.018   2.159  -1.737  0.00  0.00    +0.272 A 
ATOM     27  O   LIG    1       -4.536   2.392  -2.823  0.00  0.00    -0.266 OA
ATOM     28  N   LIG    1       -2.806   2.692  -1.371  0.00  0.00    -0.242 N 
ATOM     29  H   LIG    1       -2.348   3.299  -2.044  0.00  0.00    +0.192 HD
ATOM     30  C   LIG    1       -4.654   0.231   1.423  0.00  0.00    +0.010 A 
ATOM     31  N   LIG    1       -2.167   2.496  -0.188  0.00  0.00    -0.175 NA
ENDBRANCH  19  20
ENDBRANCH   7  19
TORSDOF 4