REMARK  Name = BDB061433
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.395   0.006   0.872  0.00  0.00    +0.265 C 
ATOM      2  N   LIG    1       -2.203   0.985  -0.088  0.00  0.00    -0.280 N 
ATOM      3  H   LIG    1       -3.018   1.515  -0.357  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1       -1.511  -0.506   1.548  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   1  10
ATOM      5  C   LIG    1       -7.506  -0.482  -1.486  0.00  0.00    +0.046 C 
ATOM      6  C   LIG    1       -7.247  -0.808  -0.043  0.00  0.00    -0.026 A 
ATOM      7  C   LIG    1       -5.990  -0.705   0.584  0.00  0.00    +0.053 A 
ATOM      8  C   LIG    1       -5.783  -1.030   1.926  0.00  0.00    +0.036 A 
ATOM      9  C   LIG    1       -4.405  -0.819   2.204  0.00  0.00    +0.043 A 
ATOM     10  C   LIG    1       -3.793  -0.341   1.058  0.00  0.00    +0.103 A 
ATOM     11  C   LIG    1       -6.877  -1.476   2.687  0.00  0.00    +0.133 A 
ATOM     12  F   LIG    1       -6.723  -1.798   3.979  0.00  0.00    -0.205 F 
ATOM     13  C   LIG    1       -8.135  -1.588   2.103  0.00  0.00    +0.039 A 
ATOM     14  N   LIG    1       -4.765  -0.318   0.083  0.00  0.00    -0.350 N 
ATOM     15  H   LIG    1       -4.597  -0.090  -0.886  0.00  0.00    +0.166 HD
ATOM     16  C   LIG    1       -8.314  -1.260   0.760  0.00  0.00    +0.008 A 
ENDBRANCH   1  10
BRANCH   2  17
ATOM     17  C   LIG    1       -0.971   1.465  -0.583  0.00  0.00    +0.035 A 
ATOM     18  C   LIG    1        0.258   0.832  -0.362  0.00  0.00    +0.046 A 
ATOM     19  C   LIG    1        1.469   1.340  -0.876  0.00  0.00    +0.031 A 
ATOM     20  C   LIG    1        1.395   2.503  -1.655  0.00  0.00    +0.023 A 
ATOM     21  C   LIG    1        0.174   3.139  -1.897  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -1.003   2.621  -1.365  0.00  0.00    +0.023 A 
BRANCH  19  23
ATOM     23  N   LIG    1        2.672   0.654  -0.622  0.00  0.00    -0.330 N 
ATOM     24  C   LIG    1        3.839   0.981  -1.446  0.00  0.00    +0.106 C 
ATOM     25  C   LIG    1        4.925  -0.079  -1.273  0.00  0.00    +0.038 C 
ATOM     26  C   LIG    1        5.333  -0.248   0.205  0.00  0.00    +0.059 C 
ATOM     27  C   LIG    1        4.057  -0.550   1.019  0.00  0.00    +0.038 C 
ATOM     28  C   LIG    1        2.980   0.513   0.811  0.00  0.00    +0.106 C 
BRANCH  26  29
ATOM     29  N   LIG    1        6.376  -1.302   0.373  0.00  0.00    -0.305 NA
ATOM     30  C   LIG    1        7.605  -0.993  -0.369  0.00  0.00    +0.104 C 
ATOM     31  C   LIG    1        6.724  -1.530   1.780  0.00  0.00    +0.104 C 
ENDBRANCH  26  29
ENDBRANCH  19  23
ENDBRANCH   2  17
TORSDOF 4