REMARK  Name = BDB032793
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -4.503   0.822   0.240  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.529  -0.043  -0.239  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.545  -1.257  -0.274  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -2.429   0.791  -0.739  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -2.810   2.125  -0.623  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1       -1.952   3.131  -1.024  0.00  0.00    +0.006 A 
ATOM      7  C   LIG    1       -0.702   2.767  -1.543  0.00  0.00    +0.007 A 
ATOM      8  C   LIG    1       -0.323   1.409  -1.669  0.00  0.00    -0.010 A 
ATOM      9  C   LIG    1       -1.207   0.402  -1.253  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -4.189   2.212  -0.062  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -9.207  -1.996   0.783  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -8.167  -1.345   0.733  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -7.749  -0.770  -0.442  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -8.329  -0.945  -1.251  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -6.704   0.105  -0.629  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -6.555   0.670  -1.712  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -5.853   0.413   0.613  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -5.893  -0.756   1.595  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -7.338  -1.056   1.962  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   8  20
ATOM     20  C   LIG    1        1.031   1.041  -2.223  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1        1.855   0.638  -1.126  0.00  0.00    -0.445 OA
BRANCH  21  22
ATOM     22  C   LIG    1        3.123   0.311  -1.486  0.00  0.00    +0.405 C 
ATOM     23  N   LIG    1        3.794  -0.067  -0.358  0.00  0.00    -0.251 N 
ATOM     24  H   LIG    1        3.223  -0.031   0.475  0.00  0.00    +0.158 HD
ATOM     25  O   LIG    1        3.540   0.363  -2.632  0.00  0.00    -0.226 OA
BRANCH  23  26
ATOM     26  C   LIG    1        5.127  -0.490  -0.232  0.00  0.00    +0.037 A 
ATOM     27  C   LIG    1        5.568  -0.828   1.058  0.00  0.00    +0.031 A 
ATOM     28  C   LIG    1        6.877  -1.254   1.226  0.00  0.00    +0.006 A 
ATOM     29  C   LIG    1        7.591  -1.632   2.467  0.00  0.00    +0.162 C 
ATOM     30  C   LIG    1        8.898  -2.133   1.857  0.00  0.00    +0.404 C 
ATOM     31  O   LIG    1        9.002  -1.761   0.472  0.00  0.00    -0.431 OA
ATOM     32  F   LIG    1        8.983  -3.483   1.938  0.00  0.00    -0.163 F 
ATOM     33  F   LIG    1        9.965  -1.621   2.515  0.00  0.00    -0.163 F 
ATOM     34  C   LIG    1        7.741  -1.340   0.150  0.00  0.00    +0.131 A 
ATOM     35  C   LIG    1        7.340  -1.008  -1.126  0.00  0.00    +0.048 A 
ATOM     36  C   LIG    1        6.019  -0.583  -1.315  0.00  0.00    +0.027 A 
ENDBRANCH  23  26
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   8  20
TORSDOF 5