REMARK  Name = BDB008369
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.166  -0.417  -0.513  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.087  -0.088  -1.863  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.917  -0.645  -2.756  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.848   0.841  -2.304  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.731   1.425  -1.392  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.698   1.067  -0.034  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.731   0.148   0.401  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  16
ATOM      8  C   LIG    1        4.037   1.065   1.282  0.00  0.00    +0.032 C 
ATOM      9  C   LIG    1        4.386   0.399  -0.050  0.00  0.00    +0.105 C 
ATOM     10  N   LIG    1        5.251  -0.749   0.149  0.00  0.00    -0.302 N 
ATOM     11  C   LIG    1        4.780  -2.032   0.246  0.00  0.00    +0.151 A 
ATOM     12  N   LIG    1        5.802  -2.841   0.415  0.00  0.00    -0.132 NA
ATOM     13  N   LIG    1        6.950  -2.085   0.402  0.00  0.00    -0.125 NA
ATOM     14  C   LIG    1        3.340  -2.387   0.131  0.00  0.00    +0.184 C 
ATOM     15  N   LIG    1        2.491  -1.218  -0.144  0.00  0.00    -0.288 N 
ATOM     16  C   LIG    1        1.117  -1.431  -0.030  0.00  0.00    +0.250 C 
ATOM     17  O   LIG    1        0.635  -2.426   0.507  0.00  0.00    -0.270 OA
ATOM     18  C   LIG    1        6.616  -0.819   0.223  0.00  0.00    +0.238 A 
ATOM     19  C   LIG    1        3.116  -0.055  -0.791  0.00  0.00    +0.133 C 
BRANCH  18  20
ATOM     20  C   LIG    1        7.514   0.353   0.100  0.00  0.00    +0.452 C 
ATOM     21  F   LIG    1        7.340   0.986  -1.093  0.00  0.00    -0.163 F 
ATOM     22  F   LIG    1        7.259   1.284   1.058  0.00  0.00    -0.163 F 
ATOM     23  F   LIG    1        8.831   0.044   0.192  0.00  0.00    -0.163 F 
ENDBRANCH  18  20
ENDBRANCH   1  16
BRANCH   6  24
ATOM     24  C   LIG    1       -2.663   1.681   0.957  0.00  0.00    +0.093 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.117   1.622   0.504  0.00  0.00    +0.074 A 
ATOM     26  C   LIG    1       -4.879   0.351   0.604  0.00  0.00    +0.011 A 
ATOM     27  C   LIG    1       -6.200   0.366   0.159  0.00  0.00    +0.050 A 
ATOM     28  C   LIG    1       -6.987  -0.791   0.214  0.00  0.00    +0.014 A 
ATOM     29  C   LIG    1       -6.446  -1.972   0.718  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1       -5.126  -1.995   1.165  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1       -6.765   1.616  -0.374  0.00  0.00    +0.272 A 
ATOM     32  O   LIG    1       -7.921   1.678  -0.774  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1       -5.922   2.700  -0.393  0.00  0.00    -0.242 N 
ATOM     34  H   LIG    1       -6.298   3.572  -0.753  0.00  0.00    +0.192 HD
ATOM     35  C   LIG    1       -4.341  -0.838   1.111  0.00  0.00    +0.010 A 
ATOM     36  N   LIG    1       -4.630   2.720   0.029  0.00  0.00    -0.175 NA
ENDBRANCH  24  25
ENDBRANCH   6  24
TORSDOF 4