REMARK  Name = BDB014817
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.585   0.369  -0.053  0.00  0.00    +0.032 A 
ATOM      2  C   LIG    1        1.340   1.535  -0.261  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1        2.740   1.502  -0.302  0.00  0.00    +0.010 A 
ATOM      4  C   LIG    1        3.439   0.299  -0.138  0.00  0.00    -0.018 A 
ATOM      5  C   LIG    1        2.686  -0.865   0.069  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        1.285  -0.828   0.111  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        4.909   0.257  -0.183  0.00  0.00    -0.018 A 
ATOM      8  C   LIG    1        5.582  -0.619  -1.050  0.00  0.00    +0.009 A 
ATOM      9  C   LIG    1        6.979  -0.660  -1.096  0.00  0.00    +0.013 A 
ATOM     10  C   LIG    1        7.744   0.173  -0.268  0.00  0.00    +0.055 A 
ATOM     11  C   LIG    1        7.081   1.056   0.594  0.00  0.00    +0.013 A 
ATOM     12  C   LIG    1        5.683   1.095   0.636  0.00  0.00    +0.009 A 
BRANCH  10  13
ATOM     13  C   LIG    1        9.251   0.146  -0.332  0.00  0.00    +0.417 C 
ATOM     14  F   LIG    1        9.746   1.026  -1.246  0.00  0.00    -0.166 F 
ATOM     15  F   LIG    1        9.752  -1.073  -0.677  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1        9.843   0.467   0.853  0.00  0.00    -0.166 F 
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  17
ATOM     17  N   LIG    1       -0.824   0.472  -0.022  0.00  0.00    -0.298 N 
ATOM     18  H   LIG    1       -1.121   1.431  -0.151  0.00  0.00    +0.154 HD
BRANCH  17  24
ATOM     19  C   LIG    1       -7.531   2.068  -0.412  0.00  0.00    +0.109 C 
ATOM     20  C   LIG    1       -6.027   2.162  -0.406  0.00  0.00    +0.213 C 
ATOM     21  N   LIG    1       -5.317   1.034  -0.013  0.00  0.00    -0.297 N 
ATOM     22  C   LIG    1       -3.852   1.199   0.069  0.00  0.00    +0.148 C 
ATOM     23  C   LIG    1       -3.173  -0.120   0.148  0.00  0.00    +0.032 A 
ATOM     24  C   LIG    1       -1.794  -0.466   0.116  0.00  0.00    +0.150 A 
ATOM     25  N   LIG    1       -1.645  -1.790   0.240  0.00  0.00    -0.156 NA
ATOM     26  N   LIG    1       -2.891  -2.284   0.326  0.00  0.00    -0.269 N 
ATOM     27  C   LIG    1       -3.072  -3.710   0.444  0.00  0.00    +0.172 C 
ATOM     28  C   LIG    1       -3.842  -1.316   0.299  0.00  0.00    +0.047 A 
ATOM     29  C   LIG    1       -5.313  -1.458   0.382  0.00  0.00    +0.074 C 
ATOM     30  C   LIG    1       -5.920  -0.086   0.744  0.00  0.00    +0.114 C 
ATOM     31  O   LIG    1       -5.471   3.206  -0.750  0.00  0.00    -0.276 OA
ENDBRANCH  17  24
ENDBRANCH   1  17
TORSDOF 4