REMARK  Name = BDB007718
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.605   1.127   1.776  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   3
ATOM      2  C   LIG    1       -2.262  -0.618   1.146  0.00  0.00    +0.246 C 
ATOM      3  N   LIG    1       -1.800   0.677   1.072  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1       -2.497   1.377   0.853  0.00  0.00    +0.149 HD
ATOM      5  O   LIG    1       -1.631  -1.510   1.707  0.00  0.00    -0.270 OA
BRANCH   2  13
ATOM      6  C   LIG    1       -6.738  -2.623   0.437  0.00  0.00    +0.149 C 
ATOM      7  N   LIG    1       -5.596  -1.754   0.260  0.00  0.00    -0.349 N 
ATOM      8  C   LIG    1       -5.505  -0.746  -0.675  0.00  0.00    +0.050 A 
ATOM      9  C   LIG    1       -4.238  -0.166  -0.530  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1       -3.877   0.869  -1.424  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1       -4.787   1.310  -2.392  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -6.046   0.732  -2.492  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1       -3.578  -0.838   0.556  0.00  0.00    +0.062 A 
ATOM     14  C   LIG    1       -6.426  -0.308  -1.641  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -4.443  -1.828   0.988  0.00  0.00    +0.099 A 
ENDBRANCH   2  13
ENDBRANCH   1   3
BRANCH   1  16
ATOM     16  C   LIG    1        0.700   0.455   1.287  0.00  0.00    +0.145 C 
BRANCH  16  17
ATOM     17  O   LIG    1        0.892  -0.781   1.985  0.00  0.00    -0.389 OA
ATOM     18  H   LIG    1        0.052  -1.287   1.910  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
BRANCH  16  19
ATOM     19  C   LIG    1        1.908   1.391   1.559  0.00  0.00    +0.117 C 
BRANCH  19  20
ATOM     20  N   LIG    1        3.229   1.043   1.003  0.00  0.00    -0.295 NA
ATOM     21  C   LIG    1        3.255   1.058  -0.467  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1        4.610   0.694  -1.041  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1        5.543  -0.031  -0.278  0.00  0.00    -0.042 A 
ATOM     24  C   LIG    1        6.777  -0.386  -0.839  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1        7.074  -0.046  -2.158  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        6.145   0.655  -2.924  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        5.239  -0.368   1.162  0.00  0.00    +0.051 C 
ATOM     28  C   LIG    1        4.917   1.021  -2.370  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1        3.745  -0.240   1.497  0.00  0.00    +0.089 C 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 6