REMARK  Name = BDB008760
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.091   0.149   0.281  0.00  0.00    +0.127 A 
ATOM      2  N   LIG    1       -0.006  -0.252  -0.396  0.00  0.00    -0.224 NA
ATOM      3  C   LIG    1        1.197   0.140   0.064  0.00  0.00    +0.116 A 
ATOM      4  C   LIG    1        1.380   0.925   1.190  0.00  0.00    +0.045 A 
ATOM      5  C   LIG    1        0.255   1.345   1.905  0.00  0.00    -0.009 A 
ATOM      6  C   LIG    1       -1.000   0.942   1.424  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1        0.384   2.174   3.117  0.00  0.00    +0.018 A 
ATOM      8  C   LIG    1       -0.387   3.332   3.311  0.00  0.00    +0.131 A 
ATOM      9  F   LIG    1       -1.271   3.719   2.377  0.00  0.00    -0.205 F 
ATOM     10  C   LIG    1       -0.264   4.117   4.457  0.00  0.00    +0.039 A 
ATOM     11  C   LIG    1        0.644   3.756   5.448  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        1.421   2.611   5.288  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        1.292   1.829   4.135  0.00  0.00    +0.011 A 
ENDBRANCH   5   7
BRANCH   1  15
ATOM     14  C   LIG    1       -2.693  -1.046  -1.194  0.00  0.00    +0.235 C 
ATOM     15  N   LIG    1       -2.371  -0.208  -0.142  0.00  0.00    -0.269 N 
ATOM     16  H   LIG    1       -3.173   0.100   0.398  0.00  0.00    +0.156 HD
ATOM     17  O   LIG    1       -1.919  -1.637  -1.937  0.00  0.00    -0.274 OA
BRANCH  14  18
ATOM     18  C   LIG    1       -4.234  -1.116  -1.387  0.00  0.00    +0.137 C 
ATOM     19  C   LIG    1       -4.624  -2.406  -2.106  0.00  0.00    +0.034 C 
BRANCH  18  21
ATOM     20  C   LIG    1       -6.297  -0.608  -0.179  0.00  0.00    +0.101 C 
ATOM     21  N   LIG    1       -4.893  -0.982  -0.057  0.00  0.00    -0.309 NA
ATOM     22  H   LIG    1       -4.830  -1.884   0.421  0.00  0.00    +0.122 HD
ENDBRANCH  18  21
ENDBRANCH  14  18
ENDBRANCH   1  15
BRANCH   3  23
ATOM     23  C   LIG    1        2.310  -0.316  -0.705  0.00  0.00    -0.041 C 
ATOM     24  C   LIG    1        3.239  -0.708  -1.358  0.00  0.00    -0.060 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.330  -1.187  -2.148  0.00  0.00    +0.025 A 
ATOM     26  C   LIG    1        4.090  -2.079  -3.196  0.00  0.00    +0.017 A 
ATOM     27  C   LIG    1        5.152  -2.550  -3.970  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1        6.454  -2.129  -3.698  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        6.696  -1.238  -2.652  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1        5.634  -0.766  -1.877  0.00  0.00    +0.017 A 
ENDBRANCH  24  25
ENDBRANCH   3  23
TORSDOF 6