# CIF file 

data_findsym-output
_audit_creation_method FINDSYM

_chemical_name_mineral 'Potassium chlorate'
_chemical_formula_sum 'K Cl O3'
 
loop_
_publ_author_name
 'Jacob Danielsen'
 'Alan Hazell'
 'Finn Krebs Larsen'
_journal_name_full
;
Acta Crystallographica B
;
_journal_volume 37
_journal_year 1981
_journal_page_first 913
_journal_page_last 915
_publ_Section_title
;
 The Structure of Potassium Chlorate at 77 and 298 K
;

_aflow_proto 'ABC3_mP10_11_e_e_ef' 
_aflow_params 'a,b/a,c/a,\beta,x1,z1,x2,z2,x3,z3,x4,y4,z4' 
_aflow_params_values '4.63,1.20259179266,1.52203023758,110.21,0.121,0.1745,0.3531,0.7086,0.4009,0.1165,0.8544,0.5361,0.6943' 
_aflow_Strukturbericht 'G0_6' 
_aflow_Pearson 'mP10' 

_symmetry_space_group_name_Hall "-P 2yb"
_symmetry_space_group_name_H-M "P 1 21/m 1"
_symmetry_Int_Tables_number 11

_cell_length_a    4.63000
_cell_length_b    5.56800
_cell_length_c    7.04700
_cell_angle_alpha 90.00000
_cell_angle_beta  110.2100
_cell_angle_gamma 90.00000
 
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,y+1/2,-z
3 -x,-y,-z
4 x,-y+1/2,z
 
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Cl1 Cl   2 e 0.12100 0.25000 0.17450 1.00000
K1  K    2 e 0.35310 0.25000 0.70860 1.00000
O1  O    2 e 0.40090 0.25000 0.11650 1.00000
O2  O    4 f 0.85440 0.53610 0.69430 1.00000
