REMARK  Name = BDB018351
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.460   3.910  -0.502  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -2.672   2.486  -0.293  0.00  0.00    -0.318 N 
ATOM      3  C   LIG    1       -3.967   1.998  -0.213  0.00  0.00    +0.252 A 
ATOM      4  O   LIG    1       -4.986   2.674  -0.315  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1       -4.090   0.538   0.004  0.00  0.00    +0.079 A 
ATOM      6  C   LIG    1       -3.014  -0.262   0.147  0.00  0.00    -0.001 A 
ATOM      7  C   LIG    1       -1.665   0.345   0.113  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -1.570   1.671  -0.116  0.00  0.00    +0.098 A 
ENDROOT
BRANCH   6   9
ATOM      9  C   LIG    1       -3.211  -1.678   0.287  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -4.047  -2.303   1.185  0.00  0.00    +0.113 A 
ATOM     11  N   LIG    1       -3.923  -3.642   0.946  0.00  0.00    -0.284 N 
ATOM     12  H   LIG    1       -4.384  -4.411   1.421  0.00  0.00    +0.188 HD
ATOM     13  N   LIG    1       -3.078  -3.931  -0.058  0.00  0.00    -0.182 NA
ATOM     14  C   LIG    1       -2.638  -2.733  -0.455  0.00  0.00    +0.142 A 
ENDBRANCH   6   9
BRANCH   7  15
ATOM     15  C   LIG    1       -0.473  -0.414   0.355  0.00  0.00    +0.022 A 
ATOM     16  C   LIG    1        0.633  -0.481  -0.462  0.00  0.00    +0.117 A 
ATOM     17  N   LIG    1        1.531  -1.291   0.181  0.00  0.00    -0.267 N 
ATOM     18  N   LIG    1        1.073  -1.759   1.362  0.00  0.00    -0.179 NA
ATOM     19  C   LIG    1       -0.147  -1.224   1.463  0.00  0.00    +0.143 A 
BRANCH  17  20
ATOM     20  C   LIG    1        2.845  -1.693  -0.304  0.00  0.00    +0.178 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.823  -0.543  -0.289  0.00  0.00    -0.026 A 
ATOM     22  C   LIG    1        4.248   0.013   0.927  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1        5.152   1.076   0.943  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        5.642   1.593  -0.254  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        5.229   1.048  -1.469  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        4.325  -0.016  -1.488  0.00  0.00    +0.005 A 
ENDBRANCH  20  21
ENDBRANCH  17  20
ENDBRANCH   7  15
TORSDOF 4