data_global
_chemical_name_mineral 'Kalicinite'
loop_
_publ_author_name
'Nitta I'
'Tomiie Y'
'Koo C H'
_journal_name_full 'Acta Crystallographica'
_journal_volume 5 
_journal_year 1952
_journal_page_first 292
_journal_page_last 292
_publ_section_title
;
 The crystal structure of potassium bicarbonate, KHCO3
;
_database_code_amcsd 0009145
_chemical_formula_sum 'K C O3'
_cell_length_a 15.11
_cell_length_b 5.67
_cell_length_c 3.71
_cell_angle_alpha 90
_cell_angle_beta 103.75
_cell_angle_gamma 90
_cell_volume 308.741
_exptl_crystal_density_diffrn      2.132
_symmetry_space_group_name_H-M 'P 1 21/a 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2-y,z'
  '1/2-x,1/2+y,-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
K   0.16330   0.02100   0.30100   0.02242
C   0.11770   0.52900  -0.15000   0.02242
OI   0.19600   0.54100   0.07800   0.02242
OII   0.08130   0.72500  -0.31700   0.02242
OIII   0.07890   0.32000  -0.23300   0.02242