REMARK  Name = BDB015923
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.321   2.471  -0.249  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1        0.355   1.534  -0.265  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -0.932   1.928  -0.201  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1       -1.278   3.278  -0.143  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.210   4.159  -0.139  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        1.087   3.792  -0.183  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.354   0.155  -0.291  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        3.032   0.628  -0.269  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.722   2.005  -0.285  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        3.801   2.904  -0.332  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        5.123   2.453  -0.362  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        5.397   1.085  -0.342  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        4.025  -4.728   0.562  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        4.475  -3.428   0.127  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        5.637  -3.317  -0.540  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        5.736  -2.005  -0.776  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.639  -1.270  -0.267  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        3.842  -2.233   0.319  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -2.645   3.763  -0.111  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.090   4.834   0.639  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -4.428   4.947   0.387  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.338   5.920   0.941  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -4.890   4.024  -0.472  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -3.804   3.310  -0.782  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -1.934   0.930  -0.213  0.00  0.00    -0.328 N 
ATOM     26  H   LIG    1       -2.562   1.092   0.572  0.00  0.00    +0.147 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.425  -0.439  -0.250  0.00  0.00    +0.103 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -2.598  -1.422  -0.238  0.00  0.00    +0.023 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -2.143  -2.865  -0.468  0.00  0.00    +0.005 C 
ATOM     30  C   LIG    1       -1.158  -3.394   0.565  0.00  0.00    +0.084 C 
ATOM     31  N   LIG    1       -1.236  -4.847   0.384  0.00  0.00    -0.316 NA
ATOM     32  H   LIG    1       -0.760  -5.088  -0.487  0.00  0.00    +0.122 HD
ATOM     33  C   LIG    1       -2.668  -5.128   0.210  0.00  0.00    +0.081 C 
ATOM     34  C   LIG    1       -3.286  -3.875  -0.401  0.00  0.00    +0.020 C 
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 7