REMARK  Name = BDB021435
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.375   0.854  -0.610  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1       -2.691   0.576   0.580  0.00  0.00    +0.051 A 
ATOM      3  C   LIG    1       -1.568  -0.276   0.625  0.00  0.00    +0.133 A 
ATOM      4  O   LIG    1       -1.089  -0.367   1.901  0.00  0.00    -0.490 OA
ATOM      5  C   LIG    1        0.226  -0.867   2.069  0.00  0.00    +0.248 C 
ATOM      6  C   LIG    1        0.263  -2.338   1.724  0.00  0.00    +0.149 C 
ATOM      7  N   LIG    1        0.600  -2.553   0.328  0.00  0.00    -0.292 N 
ATOM      8  C   LIG    1        0.008  -1.873  -0.733  0.00  0.00    +0.250 C 
ATOM      9  O   LIG    1        0.382  -2.095  -1.890  0.00  0.00    -0.270 OA
ATOM     10  C   LIG    1       -1.120  -0.895  -0.548  0.00  0.00    +0.078 A 
ATOM     11  C   LIG    1       -1.817  -0.597  -1.746  0.00  0.00    +0.017 A 
ATOM     12  C   LIG    1       -2.920   0.262  -1.782  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   1  13
ATOM     13  C   LIG    1       -4.565   1.790  -0.616  0.00  0.00    +0.119 C 
BRANCH  13  14
ATOM     14  N   LIG    1       -5.676   1.340   0.241  0.00  0.00    -0.299 NA
BRANCH  14  16
ATOM     15  C   LIG    1       -6.258   3.514   1.310  0.00  0.00    +0.020 C 
ATOM     16  C   LIG    1       -6.706   2.378   0.396  0.00  0.00    +0.081 C 
ENDBRANCH  14  16
BRANCH  14  17
ATOM     17  C   LIG    1       -6.261   0.058  -0.191  0.00  0.00    +0.081 C 
ATOM     18  C   LIG    1       -6.932   0.039  -1.562  0.00  0.00    +0.020 C 
ENDBRANCH  14  17
ENDBRANCH  13  14
ENDBRANCH   1  13
BRANCH   7  19
ATOM     19  C   LIG    1        1.635  -3.547   0.029  0.00  0.00    +0.140 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.102  -3.097   0.226  0.00  0.00    +0.146 C 
BRANCH  20  21
ATOM     21  O   LIG    1        3.426  -2.953   1.616  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1        3.258  -3.810   2.042  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        3.543  -1.865  -0.608  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        3.050  -0.551  -0.147  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        3.913   0.048   0.889  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        5.187   0.694   0.378  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        5.310   1.093  -0.965  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        6.486   1.718  -1.401  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        7.526   1.966  -0.506  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.400   1.589   0.829  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        4.207   0.792  -1.947  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        6.236   0.959   1.270  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        2.892   0.406  -1.255  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   7  19
TORSDOF 9