REMARK  Name = BDB014165
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.858  -0.148   1.956  0.00  0.00    +0.091 A 
ATOM      2  N   LIG    1        3.453  -0.769   3.002  0.00  0.00    -0.253 NA
ATOM      3  C   LIG    1        4.790  -0.935   2.958  0.00  0.00    +0.112 A 
ATOM      4  C   LIG    1        5.577  -0.522   1.900  0.00  0.00    +0.030 A 
ATOM      5  C   LIG    1        4.961   0.102   0.815  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        3.579   0.304   0.853  0.00  0.00    +0.040 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1        5.775   0.543  -0.300  0.00  0.00    +0.124 A 
ATOM      8  C   LIG    1        5.468   0.532  -1.642  0.00  0.00    +0.166 A 
ATOM      9  N   LIG    1        6.592   1.024  -2.239  0.00  0.00    -0.253 N 
ATOM     10  H   LIG    1        6.789   1.174  -3.224  0.00  0.00    +0.191 HD
ATOM     11  N   LIG    1        7.542   1.307  -1.341  0.00  0.00    -0.067 NA
ATOM     12  N   LIG    1        7.057   1.008  -0.144  0.00  0.00    -0.129 NA
BRANCH   8  13
ATOM     13  C   LIG    1        4.321   0.114  -2.438  0.00  0.00    +0.436 C 
ATOM     14  F   LIG    1        4.632   0.051  -3.759  0.00  0.00    -0.164 F 
ATOM     15  F   LIG    1        3.859  -1.107  -2.084  0.00  0.00    -0.164 F 
ATOM     16  F   LIG    1        3.286   0.982  -2.326  0.00  0.00    -0.164 F 
ENDBRANCH   8  13
ENDBRANCH   5   7
BRANCH   1  19
ATOM     17  N   LIG    1       -0.700   0.315   1.552  0.00  0.00    -0.336 N 
ATOM     18  C   LIG    1        0.542   0.226   0.987  0.00  0.00    +0.117 A 
ATOM     19  C   LIG    1        1.409   0.026   2.046  0.00  0.00    +0.107 A 
ATOM     20  N   LIG    1        0.700   0.004   3.231  0.00  0.00    -0.234 NA
ATOM     21  C   LIG    1       -0.558   0.185   2.902  0.00  0.00    +0.200 A 
BRANCH  17  22
ATOM     22  C   LIG    1       -1.950   0.517   0.849  0.00  0.00    +0.127 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.604  -0.806   0.457  0.00  0.00    +0.056 C 
BRANCH  23  28
ATOM     24  C   LIG    1       -7.612   0.121  -2.367  0.00  0.00    +0.044 C 
ATOM     25  C   LIG    1       -6.319  -0.095  -1.638  0.00  0.00    -0.050 A 
ATOM     26  C   LIG    1       -6.306  -0.244  -0.247  0.00  0.00    +0.003 A 
ATOM     27  C   LIG    1       -5.107  -0.478   0.430  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -3.902  -0.581  -0.275  0.00  0.00    -0.046 A 
ATOM     29  C   LIG    1       -3.917  -0.442  -1.668  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -5.117  -0.208  -2.344  0.00  0.00    +0.003 A 
ENDBRANCH  23  28
ENDBRANCH  22  23
ENDBRANCH  17  22
ENDBRANCH   1  19
TORSDOF 6