#-------------- QUASAR output file 'qtest.out' -------------------------
         after entering the request file 'qtest.req'




data_P6122                      


loop_
_atom_site_fract_x              
_atom_site_fract_y              
_atom_site_fract_z              
_atom_site_label                
  .20200 .79800 .91667 s
  .49800 .49800 .66667 o
  .48800 .09600 .03800 c1


loop_
_atom_site_aniso_label          
_rubbish_to_see_what_happens           # requested item not present
_atom_site_aniso_U_11           
  s ? .035(4)


#                 -----end-of-data-block-----



data_P6122                      


loop_
_atom_type_symbol               
_atom_type_oxidation_number     
_atom_type_number_in_cell       
_atom_type_scat_dispersion_REAL 
_atom_type_scat_dispersion_imag 
_atom_type_scat_source          
  S  0  6  .319  .557 Int_Tab_Vol_III_p202_Tab._3.3.1a
  O  0  6  .047  .032 Cromer,D.T._&_Mann,J.B._1968_AC_A24,321.
  C  0 20  .017  .009 Cromer,D.T._&_Mann,J.B._1968_AC_A24,321.
  RU 0  1 -.105 3.296 Cromer,D.T._&_Mann,J.B._1968_AC_A24,321.


loop_
_atom_site_label                
_atom_site_fract_x              
_atom_site_fract_y              
_atom_site_fract_z              
_atom_site_U_iso_or_equiv       
_atom_site_thermal_displace_type
_atom_site_calc_flag            
_atom_site_calc_attached_atom   
_atom_site_type_symbol          
  s  .20200 .79800 .91667 .030(3) Uij  ? ? s
  o  .49800 .49800 .66667  .02520 Uiso ? ? o
  c1 .48800 .09600 .03800  .03170 Uiso ? ? c


loop_
_atom_site_aniso_label          
_atom_site_aniso_U_11           
_atom_site_aniso_U_22           
_atom_site_aniso_U_33           
_atom_site_aniso_U_12           
_atom_site_aniso_U_13           
_atom_site_aniso_U_23           
_atom_site_aniso_type_symbol    
  s .035(4) .025(3) .025(3) .013(1) .00000 .00000 s


#                 -----end-of-data-block-----