REMARK  Name = BDB024026
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.493   1.558   0.653  0.00  0.00    -0.041 A 
ATOM      2  C   LIG    1        1.393   1.379  -0.199  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1        0.121   1.069   0.307  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -0.032   0.963   1.685  0.00  0.00    +0.134 A 
ATOM      5  F   LIG    1       -1.233   0.680   2.202  0.00  0.00    -0.205 F 
ATOM      6  C   LIG    1        1.040   1.151   2.551  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1        2.301   1.450   2.037  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   3   8
ATOM      8  P   LIG    1       -1.232   0.829  -0.798  0.00  0.00    +0.122 P 
ATOM      9  C   LIG    1       -2.562   1.978  -0.432  0.00  0.00    +0.093 C 
ATOM     10  C   LIG    1       -3.706   1.315   0.314  0.00  0.00    +0.114 C 
ATOM     11  N   LIG    1       -4.270   0.219  -0.478  0.00  0.00    -0.312 N 
ATOM     12  C   LIG    1       -3.395  -0.792  -1.088  0.00  0.00    +0.114 C 
ATOM     13  C   LIG    1       -1.997  -0.768  -0.499  0.00  0.00    +0.093 C 
ATOM     14  O   LIG    1       -0.847   0.933  -2.257  0.00  0.00    -0.316 OA
BRANCH  11  15
ATOM     15  C   LIG    1       -5.576  -0.164  -0.153  0.00  0.00    +0.157 A 
ATOM     16  C   LIG    1       -6.333  -1.024  -0.976  0.00  0.00    +0.166 A 
ATOM     17  F   LIG    1       -5.831  -1.508  -2.124  0.00  0.00    -0.202 F 
ATOM     18  C   LIG    1       -7.633  -1.380  -0.636  0.00  0.00    +0.081 A 
ATOM     19  C   LIG    1       -8.170  -0.864   0.526  0.00  0.00    +0.144 A 
ATOM     20  F   LIG    1       -9.417  -1.178   0.895  0.00  0.00    -0.204 F 
ATOM     21  C   LIG    1       -7.398  -0.017   1.297  0.00  0.00    +0.151 A 
ATOM     22  N   LIG    1       -6.128   0.341   0.981  0.00  0.00    -0.235 NA
ENDBRANCH  11  15
ENDBRANCH   3   8
BRANCH   1  23
ATOM     23  C   LIG    1        3.856   1.893   0.088  0.00  0.00    +0.093 C 
BRANCH  23  31
ATOM     24  O   LIG    1        7.789  -1.608   1.800  0.00  0.00    -0.266 OA
ATOM     25  C   LIG    1        6.908  -0.872   1.370  0.00  0.00    +0.272 A 
ATOM     26  C   LIG    1        6.050  -1.275   0.244  0.00  0.00    +0.050 A 
ATOM     27  C   LIG    1        5.061  -0.403  -0.206  0.00  0.00    +0.011 A 
ATOM     28  C   LIG    1        4.252  -0.784  -1.283  0.00  0.00    +0.010 A 
ATOM     29  C   LIG    1        4.436  -2.029  -1.893  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1        5.425  -2.897  -1.436  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1        4.933   0.897   0.503  0.00  0.00    +0.074 A 
ATOM     32  N   LIG    1        5.701   1.240   1.496  0.00  0.00    -0.175 NA
ATOM     33  C   LIG    1        6.236  -2.522  -0.366  0.00  0.00    +0.014 A 
ATOM     34  N   LIG    1        6.662   0.369   1.903  0.00  0.00    -0.242 N 
ATOM     35  H   LIG    1        7.246   0.665   2.679  0.00  0.00    +0.192 HD
ENDBRANCH  23  31
ENDBRANCH   1  23
TORSDOF 4