# CIF file
data_findsym-output
_audit_creation_method FINDSYM

_chemical_name_mineral 'Sr[S2O6][H2O]4'
_chemical_formula_sum 'O10 S2 Sr'

loop_
_publ_author_name
 'R. N. Hargreaves'
 'E. Stanley'
_journal_name_full_name
;
 Zeitschrift f{\"u}r Kristallographie - Crystalline Materials
;
_journal_volume 135
_journal_year 1972
_journal_page_first 399
_journal_page_last 407
_publ_Section_title
;
 The structure of strontium dithionate tetrahydrate
;

_aflow_title 'Sr[S$_{2}$O$_{6}$][H$_{2}$O]$_{4}$ Structure'
_aflow_proto 'A10B2C_hP39_172_5c_c_a'
_aflow_params 'a,c/a,z_{1},x_{2},y_{2},z_{2},x_{3},y_{3},z_{3},x_{4},y_{4},z_{4},x_{5},y_{5},z_{5},x_{6},y_{6},z_{6},x_{7},y_{7},z_{7}'
_aflow_params_values '6.3199906634,3.05221518986,0.0,-0.004,0.253,0.76367,0.015,0.248,0.88966,0.681,0.192,0.83267,0.448,0.188,0.70467,0.449,0.25,-0.048,0.373,0.065,0.49533'
_aflow_Strukturbericht 'None'
_aflow_Pearson 'hP39'

_cell_length_a    6.3199906634
_cell_length_b    6.3199906634
_cell_length_c    19.2899715026
_cell_angle_alpha 90.0000000000
_cell_angle_beta  90.0000000000
_cell_angle_gamma 120.0000000000
 
_symmetry_space_group_name_H-M "P 64"
_symmetry_Int_Tables_number 172
 
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 x-y,x,z+2/3
3 -y,x-y,z+1/3
4 -x,-y,z
5 -x+y,-x,z+2/3
6 y,-x+y,z+1/3
 
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
Sr1 Sr   3 a 0.00000  0.00000 0.00000  1.00000
O1  O    6 c -0.00400 0.25300 0.76367  1.00000
O2  O    6 c 0.01500  0.24800 0.88966  1.00000
O3  O    6 c 0.68100  0.19200 0.83267  1.00000
O4  O    6 c 0.44800  0.18800 0.70467  1.00000
O5  O    6 c 0.44900  0.25000 -0.04800 1.00000
S1  S    6 c 0.37300  0.06500 0.49533  1.00000
