REMARK  Name = BDB015907
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.574  -0.114   0.140  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1        0.229  -0.084   0.074  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -0.470  -0.960   0.829  0.00  0.00    +0.132 A 
ATOM      4  C   LIG    1        0.169  -1.891   1.649  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1        1.550  -1.836   1.641  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1        2.275  -0.970   0.903  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.463   1.830  -1.432  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        3.734   0.914  -0.654  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.324   0.856  -0.685  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        1.664   1.762  -1.535  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        2.371   2.681  -2.313  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        3.763   2.715  -2.260  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        9.229   0.518  -0.950  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        8.018   1.269  -1.168  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        8.097   2.574  -1.484  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        6.818   2.939  -1.613  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        5.915   1.874  -1.381  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        6.737   0.802  -1.097  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -0.533  -2.845   2.501  0.00  0.00    +0.097 A 
ATOM     20  N   LIG    1       -1.705  -2.538   3.090  0.00  0.00    -0.171 NA
ATOM     21  N   LIG    1       -2.030  -3.638   3.792  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -3.254  -3.657   4.555  0.00  0.00    +0.172 C 
ATOM     23  C   LIG    1       -1.115  -4.640   3.687  0.00  0.00    +0.108 A 
ATOM     24  C   LIG    1       -0.129  -4.161   2.858  0.00  0.00    +0.049 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -1.875  -0.994   0.689  0.00  0.00    -0.327 N 
ATOM     26  H   LIG    1       -2.262  -1.232   1.611  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -2.471   0.215   0.121  0.00  0.00    +0.118 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -4.006   0.050   0.042  0.00  0.00    +0.103 C 
BRANCH  28  29
ATOM     29  N   LIG    1       -4.728   1.250  -0.424  0.00  0.00    -0.297 NA
ATOM     30  C   LIG    1       -6.194   1.067  -0.346  0.00  0.00    +0.112 C 
ATOM     31  C   LIG    1       -6.840   0.709  -1.693  0.00  0.00    +0.175 C 
ATOM     32  O   LIG    1       -6.626   1.705  -2.703  0.00  0.00    -0.377 OA
ATOM     33  C   LIG    1       -5.417   2.451  -2.508  0.00  0.00    +0.175 C 
ATOM     34  C   LIG    1       -4.326   1.635  -1.796  0.00  0.00    +0.112 C 
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 7