REMARK  Name = BDB026621
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -2.673  -1.825  -1.484  0.00  0.00    -0.274 OA
ATOM      2  C   LIG    1       -2.531  -0.685  -1.045  0.00  0.00    +0.237 C 
ATOM      3  N   LIG    1       -1.442  -0.211  -0.338  0.00  0.00    -0.284 N 
ATOM      4  H   LIG    1       -1.479   0.775  -0.071  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1       -0.272  -0.906   0.023  0.00  0.00    +0.033 A 
ATOM      6  C   LIG    1       -0.053  -2.257  -0.235  0.00  0.00    +0.024 A 
ATOM      7  C   LIG    1        1.141  -2.872   0.164  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1        2.146  -2.154   0.829  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1        1.915  -0.794   1.082  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1        0.723  -0.178   0.683  0.00  0.00    +0.024 A 
BRANCH   8  11
ATOM     11  C   LIG    1        3.400  -2.804   1.243  0.00  0.00    -0.018 A 
ATOM     12  C   LIG    1        4.184  -3.516   0.321  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1        5.376  -4.133   0.712  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        5.803  -4.048   2.034  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1        5.040  -3.347   2.965  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1        3.850  -2.731   2.572  0.00  0.00    +0.008 A 
ENDBRANCH   8  11
ENDBRANCH   3   5
BRANCH   2  17
ATOM     17  C   LIG    1       -3.621   0.351  -1.243  0.00  0.00    +0.219 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -3.259   1.343  -2.239  0.00  0.00    -0.320 N 
ATOM     19  C   LIG    1       -2.769   2.623  -2.046  0.00  0.00    +0.160 A 
ATOM     20  N   LIG    1       -2.674   3.236  -3.219  0.00  0.00    -0.234 NA
ATOM     21  C   LIG    1       -3.066   2.337  -4.172  0.00  0.00    +0.131 A 
ATOM     22  C   LIG    1       -3.436   1.155  -3.588  0.00  0.00    +0.108 A 
BRANCH  19  23
ATOM     23  C   LIG    1       -2.414   3.250  -0.763  0.00  0.00    +0.106 A 
ATOM     24  N   LIG    1       -2.175   2.421   0.288  0.00  0.00    -0.252 NA
ATOM     25  C   LIG    1       -1.855   3.007   1.469  0.00  0.00    +0.111 A 
ATOM     26  C   LIG    1       -1.738   4.374   1.651  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1       -1.965   5.202   0.560  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -2.306   4.635  -0.665  0.00  0.00    +0.031 A 
ENDBRANCH  19  23
ENDBRANCH  17  18
ENDBRANCH   2  17
TORSDOF 5