REMARK  Name = BDB026330
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.235   1.663   1.186  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1        0.091   0.707   0.100  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1        1.528   0.836  -0.458  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1        2.512   0.591   0.612  0.00  0.00    -0.324 N 
ATOM      5  C   LIG    1        2.128   1.038   1.963  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1        0.983   2.077   1.914  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.834   0.272   0.317  0.00  0.00    +0.085 A 
ATOM      8  C   LIG    1        4.431   0.392  -0.958  0.00  0.00    +0.235 A 
ATOM      9  F   LIG    1        3.708   0.890  -1.977  0.00  0.00    -0.182 F 
ATOM     10  N   LIG    1        5.709   0.075  -1.277  0.00  0.00    -0.213 NA
ATOM     11  C   LIG    1        6.470  -0.405  -0.265  0.00  0.00    +0.129 A 
ATOM     12  C   LIG    1        6.009  -0.580   1.029  0.00  0.00    +0.035 A 
ATOM     13  C   LIG    1        4.684  -0.240   1.310  0.00  0.00    +0.030 A 
BRANCH  11  14
ATOM     14  C   LIG    1        7.885  -0.762  -0.609  0.00  0.00    +0.262 C 
ATOM     15  N   LIG    1        8.231  -0.508  -1.919  0.00  0.00    -0.313 N 
ATOM     16  H   LIG    1        7.480  -0.198  -2.530  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1        9.501  -0.895  -2.470  0.00  0.00    +0.128 C 
ATOM     18  O   LIG    1        8.641  -1.245   0.225  0.00  0.00    -0.269 OA
ENDBRANCH  11  14
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1       -1.256   1.125   2.096  0.00  0.00    +0.121 C 
BRANCH  19  29
ATOM     20  C   LIG    1       -6.935  -0.680  -0.540  0.00  0.00    +0.019 A 
ATOM     21  C   LIG    1       -6.277  -1.899   0.039  0.00  0.00    +0.252 A 
ATOM     22  O   LIG    1       -6.801  -3.006  -0.014  0.00  0.00    -0.268 OA
ATOM     23  N   LIG    1       -5.056  -1.725   0.637  0.00  0.00    -0.321 N 
ATOM     24  H   LIG    1       -4.628  -2.557   1.018  0.00  0.00    +0.169 HD
ATOM     25  C   LIG    1       -4.422  -0.481   0.738  0.00  0.00    +0.068 A 
ATOM     26  C   LIG    1       -5.035   0.655   0.214  0.00  0.00    +0.088 A 
ATOM     27  N   LIG    1       -4.497   1.891   0.268  0.00  0.00    -0.253 NA
ATOM     28  C   LIG    1       -3.288   1.990   0.872  0.00  0.00    +0.116 A 
ATOM     29  C   LIG    1       -2.592   0.915   1.429  0.00  0.00    -0.013 A 
ATOM     30  C   LIG    1       -3.184  -0.352   1.356  0.00  0.00    +0.034 A 
ATOM     31  C   LIG    1       -6.334   0.519  -0.434  0.00  0.00    +0.038 A 
BRANCH  20  33
ATOM     32  C   LIG    1       -8.170  -1.454  -2.587  0.00  0.00    +0.009 C 
ATOM     33  C   LIG    1       -8.279  -0.865  -1.187  0.00  0.00    +0.037 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 5