REMARK  Name = BDB063380
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.647   0.038   0.255  0.00  0.00    +0.040 C 
ATOM      2  C   LIG    1        1.191  -1.431   0.446  0.00  0.00    +0.051 C 
ATOM      3  C   LIG    1       -0.116  -0.629   0.210  0.00  0.00    +0.038 C 
ATOM      4  C   LIG    1        0.455   0.422   1.181  0.00  0.00    +0.051 C 
ATOM      5  C   LIG    1        0.634   0.101  -0.923  0.00  0.00    +0.051 C 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1        3.978   0.155  -0.531  0.00  0.00    +0.254 C 
ATOM      7  N   LIG    1        2.962   0.567   0.313  0.00  0.00    -0.307 N 
ATOM      8  H   LIG    1        3.198   1.310   0.969  0.00  0.00    +0.149 HD
ATOM      9  O   LIG    1        3.810  -0.685  -1.410  0.00  0.00    -0.272 OA
BRANCH   6  11
ATOM     10  C   LIG    1        6.252   0.696  -1.487  0.00  0.00    +0.061 C 
ATOM     11  C   LIG    1        5.320   0.851  -0.285  0.00  0.00    +0.234 C 
BRANCH  11  12
ATOM     12  C   LIG    1        5.934   0.188   0.954  0.00  0.00    +0.427 C 
ATOM     13  F   LIG    1        6.115  -1.141   0.788  0.00  0.00    -0.167 F 
ATOM     14  F   LIG    1        7.149   0.718   1.241  0.00  0.00    -0.167 F 
ATOM     15  F   LIG    1        5.161   0.359   2.054  0.00  0.00    -0.167 F 
ENDBRANCH  11  12
BRANCH  11  16
ATOM     16  O   LIG    1        5.070   2.263  -0.083  0.00  0.00    -0.373 OA
ATOM     17  H   LIG    1        4.775   2.630  -0.938  0.00  0.00    +0.211 HD
ENDBRANCH  11  16
ENDBRANCH   6  11
ENDBRANCH   1   7
BRANCH   3  18
ATOM     18  N   LIG    1       -1.379  -1.187   0.201  0.00  0.00    -0.335 N 
ATOM     19  H   LIG    1       -1.477  -2.086   0.685  0.00  0.00    +0.147 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -2.600  -0.544   0.083  0.00  0.00    +0.079 C 
ATOM     21  C   LIG    1       -3.786  -1.372   0.499  0.00  0.00    +0.209 C 
ATOM     22  O   LIG    1       -3.624  -2.503   0.950  0.00  0.00    -0.285 OA
ATOM     23  C   LIG    1       -5.131  -0.801   0.369  0.00  0.00    +0.053 A 
ATOM     24  C   LIG    1       -5.315   0.490  -0.087  0.00  0.00    +0.121 A 
ATOM     25  N   LIG    1       -6.540   1.068  -0.220  0.00  0.00    -0.251 NA
ATOM     26  C   LIG    1       -7.613   0.320   0.116  0.00  0.00    +0.111 A 
ATOM     27  C   LIG    1       -7.523  -0.981   0.582  0.00  0.00    +0.020 A 
ATOM     28  C   LIG    1       -4.146   1.322  -0.457  0.00  0.00    +0.207 C 
ATOM     29  O   LIG    1       -4.239   2.482  -0.840  0.00  0.00    -0.286 OA
ATOM     30  C   LIG    1       -6.259  -1.551   0.711  0.00  0.00    +0.015 A 
ATOM     31  C   LIG    1       -2.809   0.704  -0.352  0.00  0.00    +0.079 C 
ENDBRANCH  18  20
ENDBRANCH   3  18
TORSDOF 6