REMARK  Name = BDB008918
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.862   0.513   1.003  0.00  0.00    +0.018 A 
ATOM      2  C   LIG    1       -1.000   1.901   1.134  0.00  0.00    +0.131 A 
ATOM      3  F   LIG    1       -1.693   2.416   2.162  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.454   2.782   0.204  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        0.259   2.287  -0.885  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        0.442   0.906  -1.039  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.131   0.032  -0.098  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1   9
ATOM      8  C   LIG    1       -2.427  -1.373   1.653  0.00  0.00    +0.045 A 
ATOM      9  C   LIG    1       -1.452  -0.412   1.987  0.00  0.00    -0.003 A 
ATOM     10  C   LIG    1       -1.034  -0.359   3.330  0.00  0.00    +0.009 A 
ATOM     11  C   LIG    1       -1.552  -1.236   4.289  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -2.498  -2.192   3.929  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -2.936  -2.265   2.609  0.00  0.00    +0.013 A 
BRANCH   8  15
ATOM     14  N   LIG    1       -3.978  -0.668  -0.144  0.00  0.00    -0.298 N 
ATOM     15  C   LIG    1       -2.945  -1.508   0.278  0.00  0.00    +0.247 C 
ATOM     16  O   LIG    1       -2.443  -2.384  -0.423  0.00  0.00    -0.270 OA
BRANCH  14  18
ATOM     17  C   LIG    1       -4.710   1.701   0.182  0.00  0.00    +0.024 C 
ATOM     18  C   LIG    1       -4.691   0.280   0.722  0.00  0.00    +0.104 C 
ENDBRANCH  14  18
BRANCH  14  19
ATOM     19  C   LIG    1       -4.471  -0.855  -1.508  0.00  0.00    +0.104 C 
ATOM     20  C   LIG    1       -3.584  -0.171  -2.539  0.00  0.00    +0.024 C 
ENDBRANCH  14  19
ENDBRANCH   8  15
ENDBRANCH   1   9
BRANCH   6  21
ATOM     21  C   LIG    1        1.208   0.364  -2.225  0.00  0.00    +0.092 C 
BRANCH  21  22
ATOM     22  C   LIG    1        2.334  -0.594  -1.844  0.00  0.00    +0.069 A 
ATOM     23  C   LIG    1        3.579  -0.063  -1.202  0.00  0.00    -0.016 A 
ATOM     24  C   LIG    1        3.769   1.411  -0.978  0.00  0.00    +0.037 C 
ATOM     25  C   LIG    1        5.217   1.792  -0.653  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1        5.822   0.827   0.359  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1        5.802  -0.608  -0.171  0.00  0.00    +0.041 C 
ATOM     28  C   LIG    1        4.510  -0.967  -0.852  0.00  0.00    +0.023 A 
ATOM     29  C   LIG    1        4.292  -2.409  -1.132  0.00  0.00    +0.268 A 
ATOM     30  O   LIG    1        5.126  -3.258  -0.833  0.00  0.00    -0.266 OA
ATOM     31  N   LIG    1        3.114  -2.726  -1.751  0.00  0.00    -0.243 N 
ATOM     32  H   LIG    1        2.937  -3.707  -1.943  0.00  0.00    +0.192 HD
ATOM     33  N   LIG    1        2.135  -1.852  -2.102  0.00  0.00    -0.175 NA
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 6