REMARK  Name = BDB018584
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.104  -2.507   0.718  0.00  0.00    -0.003 A 
ATOM      2  C   LIG    1       -0.663  -2.794   0.889  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1       -0.289  -4.074   1.092  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1       -1.190  -5.121   1.146  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1       -0.683  -6.463   1.386  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -2.555  -4.928   0.994  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1       -3.403  -5.814   1.031  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -2.983  -3.528   0.764  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  13
ATOM      9  N   LIG    1       -3.643   1.412  -0.045  0.00  0.00    -0.315 N 
ATOM     10  C   LIG    1       -3.949   0.812   1.174  0.00  0.00    +0.252 A 
ATOM     11  O   LIG    1       -4.639   1.319   2.054  0.00  0.00    -0.268 OA
ATOM     12  C   LIG    1       -3.385  -0.546   1.393  0.00  0.00    +0.078 A 
ATOM     13  C   LIG    1       -2.649  -1.164   0.450  0.00  0.00    -0.011 A 
ATOM     14  C   LIG    1       -2.416  -0.467  -0.806  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -2.900   0.763  -1.013  0.00  0.00    +0.089 A 
BRANCH   9  16
ATOM     16  C   LIG    1       -4.174   2.745  -0.322  0.00  0.00    +0.124 C 
BRANCH  16  18
ATOM     17  C   LIG    1       -6.115   4.069  -1.233  0.00  0.00    +0.005 C 
ATOM     18  C   LIG    1       -5.565   2.680  -0.954  0.00  0.00    +0.018 C 
ENDBRANCH  16  18
ENDBRANCH   9  16
ENDBRANCH   1  13
BRANCH   2  19
ATOM     19  C   LIG    1        0.322  -1.753   0.847  0.00  0.00    +0.022 A 
ATOM     20  C   LIG    1        1.457  -1.736   0.066  0.00  0.00    +0.123 A 
ATOM     21  N   LIG    1        2.127  -0.554   0.335  0.00  0.00    -0.238 N 
ATOM     22  N   LIG    1        1.460   0.167   1.260  0.00  0.00    -0.174 NA
ATOM     23  C   LIG    1        0.381  -0.551   1.567  0.00  0.00    +0.143 A 
BRANCH  21  24
ATOM     24  C   LIG    1        3.337  -0.075  -0.260  0.00  0.00    +0.083 A 
ATOM     25  C   LIG    1        4.012   1.082   0.209  0.00  0.00    +0.081 A 
ATOM     26  C   LIG    1        5.192   1.542  -0.445  0.00  0.00    -0.025 A 
ATOM     27  C   LIG    1        5.683   0.795  -1.531  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1        5.033  -0.345  -1.986  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        3.866  -0.776  -1.360  0.00  0.00    +0.029 A 
BRANCH  26  30
ATOM     30  C   LIG    1        5.958   2.775   0.015  0.00  0.00    +0.020 C 
ATOM     31  C   LIG    1        5.321   4.142  -0.102  0.00  0.00    +0.009 C 
ATOM     32  C   LIG    1        6.474   3.787  -0.985  0.00  0.00    +0.009 C 
ENDBRANCH  26  30
BRANCH  25  33
ATOM     33  C   LIG    1        3.601   1.819   1.381  0.00  0.00    +0.102 C 
ATOM     34  N   LIG    1        3.364   2.455   2.325  0.00  0.00    -0.191 NA
ENDBRANCH  25  33
ENDBRANCH  21  24
ENDBRANCH   2  19
TORSDOF 7