REMARK  Name = BDB009522
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.636   0.560  -1.247  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.977   0.973  -2.532  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        2.168   1.535  -2.784  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.079   0.814  -3.580  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.183   0.266  -3.336  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.558  -0.119  -2.039  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.634   0.028  -0.994  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  N   LIG    1        2.814   0.203  -0.099  0.00  0.00    -0.296 N 
ATOM      9  C   LIG    1        1.546   0.789  -0.113  0.00  0.00    +0.249 C 
ATOM     10  O   LIG    1        1.123   1.498   0.799  0.00  0.00    -0.270 OA
BRANCH   8  12
ATOM     11  C   LIG    1        2.510  -2.226  -0.614  0.00  0.00    +0.024 C 
ATOM     12  C   LIG    1        3.217  -0.919  -0.954  0.00  0.00    +0.105 C 
ENDBRANCH   8  12
BRANCH   8  13
ATOM     13  C   LIG    1        3.711   0.599   0.994  0.00  0.00    +0.126 C 
BRANCH  13  14
ATOM     14  C   LIG    1        3.549  -0.225   2.278  0.00  0.00    +0.123 C 
BRANCH  14  15
ATOM     15  N   LIG    1        4.304  -1.468   2.249  0.00  0.00    -0.314 N 
ATOM     16  H   LIG    1        5.244  -1.455   1.879  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1        3.972  -2.513   3.074  0.00  0.00    +0.216 C 
ATOM     18  O   LIG    1        2.957  -2.585   3.750  0.00  0.00    -0.276 OA
BRANCH  17  19
ATOM     19  C   LIG    1        4.960  -3.620   3.079  0.00  0.00    +0.075 C 
ATOM     20  C   LIG    1        6.425  -3.376   3.365  0.00  0.00    +0.013 C 
ATOM     21  C   LIG    1        5.572  -4.063   4.390  0.00  0.00    +0.013 C 
ENDBRANCH  17  19
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH   8  13
ENDBRANCH   1   9
BRANCH   6  22
ATOM     22  C   LIG    1       -2.934  -0.686  -1.775  0.00  0.00    +0.092 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -4.058   0.299  -2.082  0.00  0.00    +0.069 A 
ATOM     24  C   LIG    1       -4.403   1.371  -1.095  0.00  0.00    -0.016 A 
ATOM     25  C   LIG    1       -3.663   1.498   0.205  0.00  0.00    +0.037 C 
ATOM     26  C   LIG    1       -4.365   2.405   1.221  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1       -4.883   3.675   0.562  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -5.857   3.351  -0.572  0.00  0.00    +0.041 C 
ATOM     29  C   LIG    1       -5.402   2.206  -1.434  0.00  0.00    +0.023 A 
ATOM     30  C   LIG    1       -6.115   2.028  -2.723  0.00  0.00    +0.268 A 
ATOM     31  O   LIG    1       -7.049   2.752  -3.052  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -5.665   1.011  -3.522  0.00  0.00    -0.243 N 
ATOM     33  H   LIG    1       -6.136   0.879  -4.410  0.00  0.00    +0.192 HD
ATOM     34  N   LIG    1       -4.659   0.147  -3.226  0.00  0.00    -0.175 NA
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 8