REMARK  Name = BDB032392
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.320  -0.713   0.695  0.00  0.00    -0.019 A 
ATOM      2  C   LIG    1       -0.194   0.506   1.156  0.00  0.00    +0.044 A 
ATOM      3  C   LIG    1       -1.387   0.538   1.871  0.00  0.00    +0.128 A 
ATOM      4  F   LIG    1       -1.853   1.721   2.300  0.00  0.00    -0.205 F 
ATOM      5  C   LIG    1       -2.109  -0.628   2.141  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1       -1.601  -1.847   1.673  0.00  0.00    +0.008 A 
ATOM      7  C   LIG    1       -0.402  -1.887   0.953  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   1   8
ATOM      8  C   LIG    1        1.593  -0.756  -0.113  0.00  0.00    +0.195 C 
BRANCH   8   9
ATOM      9  O   LIG    1        2.572   0.080   0.504  0.00  0.00    -0.372 OA
BRANCH   9  13
ATOM     10  N   LIG    1        6.463   0.209  -0.970  0.00  0.00    -0.302 NA
ATOM     11  C   LIG    1        5.911   1.488  -0.488  0.00  0.00    +0.087 C 
ATOM     12  C   LIG    1        4.592   1.342   0.277  0.00  0.00    +0.047 C 
ATOM     13  C   LIG    1        3.796   0.148  -0.235  0.00  0.00    +0.121 C 
ATOM     14  C   LIG    1        4.614  -1.140  -0.070  0.00  0.00    +0.047 C 
ATOM     15  C   LIG    1        6.125  -0.890  -0.064  0.00  0.00    +0.087 C 
BRANCH  10  17
ATOM     16  C   LIG    1        8.291   1.275  -2.295  0.00  0.00    +0.020 C 
ATOM     17  C   LIG    1        7.913   0.281  -1.202  0.00  0.00    +0.081 C 
ENDBRANCH  10  17
ENDBRANCH   9  13
ENDBRANCH   8   9
ENDBRANCH   1   8
BRANCH   5  18
ATOM     18  C   LIG    1       -3.396  -0.561   2.920  0.00  0.00    +0.139 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -4.435   0.170   2.197  0.00  0.00    -0.339 N 
ATOM     20  H   LIG    1       -4.108   1.113   2.006  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -5.105  -0.372   1.083  0.00  0.00    +0.035 A 
ATOM     22  C   LIG    1       -5.837   0.485   0.197  0.00  0.00    +0.008 A 
ATOM     23  C   LIG    1       -6.532  -0.065  -0.913  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -7.215   0.820  -1.786  0.00  0.00    +0.124 A 
ATOM     25  N   LIG    1       -7.256   2.151  -1.611  0.00  0.00    -0.240 NA
ATOM     26  C   LIG    1       -6.617   2.652  -0.543  0.00  0.00    +0.113 A 
ATOM     27  C   LIG    1       -6.523  -1.464  -1.093  0.00  0.00    +0.012 A 
ATOM     28  C   LIG    1       -5.872  -2.302  -0.197  0.00  0.00    +0.003 A 
ATOM     29  C   LIG    1       -5.914   1.882   0.365  0.00  0.00    +0.030 A 
ATOM     30  C   LIG    1       -5.188  -1.759   0.886  0.00  0.00    +0.023 A 
BRANCH  24  31
ATOM     31  N   LIG    1       -7.918   0.345  -2.908  0.00  0.00    -0.343 N 
ATOM     32  H   LIG    1       -8.645  -0.290  -2.597  0.00  0.00    +0.144 HD
ATOM     33  H   LIG    1       -7.277  -0.158  -3.513  0.00  0.00    +0.144 HD
ENDBRANCH  24  31
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH   5  18
TORSDOF 8