REMARK  Name = BDB015189
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.111  -1.448  -2.747  0.00  0.00    -0.326 N 
ATOM      2  H   LIG    1       -0.417  -2.126  -2.047  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   7
ATOM      3  C   LIG    1        2.986  -0.413  -1.134  0.00  0.00    +0.076 A 
ATOM      4  N   LIG    1        2.942   0.926  -1.286  0.00  0.00    -0.235 NA
ATOM      5  C   LIG    1        1.881   1.412  -1.938  0.00  0.00    +0.223 A 
ATOM      6  N   LIG    1        0.856   0.701  -2.426  0.00  0.00    -0.221 NA
ATOM      7  C   LIG    1        0.902  -0.626  -2.240  0.00  0.00    +0.123 A 
ATOM      8  C   LIG    1        1.971  -1.229  -1.604  0.00  0.00    +0.071 A 
BRANCH   3  16
ATOM      9  C   LIG    1        8.467  -1.155   3.561  0.00  0.00    +0.172 C 
ATOM     10  N   LIG    1        7.504  -1.308   2.498  0.00  0.00    -0.273 N 
ATOM     11  N   LIG    1        6.539  -0.376   2.350  0.00  0.00    -0.171 NA
ATOM     12  C   LIG    1        5.821  -0.791   1.292  0.00  0.00    +0.093 A 
ATOM     13  C   LIG    1        6.377  -2.022   0.799  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1        5.930  -2.773  -0.277  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1        4.799  -2.171  -0.873  0.00  0.00    +0.011 A 
ATOM     16  C   LIG    1        4.176  -0.941  -0.431  0.00  0.00    +0.003 A 
ATOM     17  C   LIG    1        4.698  -0.215   0.678  0.00  0.00    +0.040 A 
ATOM     18  C   LIG    1        7.450  -2.325   1.589  0.00  0.00    +0.116 A 
ENDBRANCH   3  16
ENDBRANCH   1   7
BRANCH   1  19
ATOM     19  C   LIG    1       -1.289  -0.793  -3.324  0.00  0.00    +0.135 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.415  -0.595  -2.291  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -2.623  -1.821  -1.562  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -3.127  -1.546  -0.767  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -2.154   0.543  -1.282  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -3.238   0.634  -0.268  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -4.476   1.195  -0.851  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -5.550   1.506   0.171  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -5.231   1.671   1.529  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -6.239   1.985   2.450  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -7.554   2.162   2.022  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -7.872   2.019   0.673  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -3.818   1.446   2.000  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -6.876   1.696  -0.248  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -2.803   1.493   0.851  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 7