REMARK  Name = BDB031008
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.424   1.026   0.062  0.00  0.00    +0.090 A 
ATOM      2  C   LIG    1        1.051   1.935   0.883  0.00  0.00    +0.099 A 
ATOM      3  C   LIG    1        2.422   1.938   0.782  0.00  0.00    +0.129 A 
ATOM      4  N   LIG    1        3.118   1.125  -0.037  0.00  0.00    -0.222 NA
ATOM      5  C   LIG    1        2.422   0.278  -0.797  0.00  0.00    +0.216 A 
ATOM      6  N   LIG    1        1.093   0.186  -0.762  0.00  0.00    -0.214 NA
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1       -4.215  -0.887   0.268  0.00  0.00    +0.053 A 
ATOM      8  C   LIG    1       -3.154   0.036   0.073  0.00  0.00    +0.059 A 
ATOM      9  C   LIG    1       -1.809  -0.293   0.285  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1       -1.019   0.866   0.010  0.00  0.00    +0.026 A 
ATOM     11  C   LIG    1       -1.884   1.857  -0.396  0.00  0.00    +0.093 A 
ATOM     12  C   LIG    1       -1.482  -1.595   0.704  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1       -2.502  -2.525   0.900  0.00  0.00    +0.020 A 
ATOM     14  N   LIG    1       -3.156   1.355  -0.341  0.00  0.00    -0.359 N 
ATOM     15  H   LIG    1       -3.972   1.893  -0.593  0.00  0.00    +0.165 HD
ATOM     16  C   LIG    1       -3.845  -2.186   0.690  0.00  0.00    +0.064 A 
BRANCH   7  18
ATOM     17  C   LIG    1       -6.094   0.167  -1.698  0.00  0.00    +0.086 C 
ATOM     18  P   LIG    1       -5.896  -0.418  -0.008  0.00  0.00    +0.114 P 
ATOM     19  O   LIG    1       -6.945  -1.465   0.253  0.00  0.00    -0.317 OA
ATOM     20  C   LIG    1       -6.297   1.031   0.983  0.00  0.00    +0.086 C 
ENDBRANCH   7  18
BRANCH  16  21
ATOM     21  C   LIG    1       -4.804  -3.234   0.923  0.00  0.00    +0.100 C 
ATOM     22  N   LIG    1       -5.482  -4.152   1.138  0.00  0.00    -0.191 NA
ENDBRANCH  16  21
ENDBRANCH   1  10
BRANCH   2  23
ATOM     23  C   LIG    1        0.347   2.850   1.814  0.00  0.00    +0.421 C 
ATOM     24  F   LIG    1        1.193   3.462   2.693  0.00  0.00    -0.166 F 
ATOM     25  F   LIG    1       -0.585   2.233   2.591  0.00  0.00    -0.166 F 
ATOM     26  F   LIG    1       -0.298   3.865   1.176  0.00  0.00    -0.166 F 
ENDBRANCH   2  23
BRANCH   5  27
ATOM     27  N   LIG    1        3.054  -0.576  -1.672  0.00  0.00    -0.309 N 
ATOM     28  H   LIG    1        2.380  -1.281  -1.951  0.00  0.00    +0.149 HD
BRANCH  27  29
ATOM     29  C   LIG    1        4.411  -1.049  -1.419  0.00  0.00    +0.091 C 
ATOM     30  C   LIG    1        4.576  -1.757  -0.060  0.00  0.00    +0.126 C 
ATOM     31  N   LIG    1        5.971  -1.977   0.247  0.00  0.00    -0.314 N 
ATOM     32  H   LIG    1        6.268  -2.779   0.791  0.00  0.00    +0.149 HD
ATOM     33  C   LIG    1        6.870  -0.944   0.189  0.00  0.00    +0.213 C 
ATOM     34  O   LIG    1        7.995  -1.053   0.661  0.00  0.00    -0.276 OA
ATOM     35  C   LIG    1        6.348   0.328  -0.442  0.00  0.00    +0.097 C 
ATOM     36  C   LIG    1        5.477   0.039  -1.664  0.00  0.00    +0.033 C 
ENDBRANCH  27  29
ENDBRANCH   5  27
TORSDOF 6