# CIF file
data_findsym-output
_audit_creation_method FINDSYM

_chemical_name_mineral 'RuIn3'
_chemical_formula_sum 'In3 Ru'

loop_
_publ_author_name
 'R. B. Roof'
 'Z. Fisk'
 'J. L. Smith'
_journal_name_full_name
;
 Powder Diffraction
;
_journal_volume 1
_journal_year 1986
_journal_page_first 20
_journal_page_last 21
_publ_Section_title
;
 Crystal data for RuIn$_{3}$
;

# Found in Pearson's Crystal Data - Crystal Structure Database for Inorganic Compounds, 2013

_aflow_title 'RuIn$_{3}$ Structure'
_aflow_proto 'A3B_tP16_118_ei_f'
_aflow_params 'a,c/a,z_{1},x_{2},x_{3},y_{3},z_{3}'
_aflow_params_values '6.9983025398,1.03510852635,0.237,0.15,0.343,0.149,0.509'
_aflow_Strukturbericht 'None'
_aflow_Pearson 'tP16'

_cell_length_a    6.9983025398
_cell_length_b    6.9983025398
_cell_length_c    7.2440026289
_cell_angle_alpha 90.0000000000
_cell_angle_beta  90.0000000000
_cell_angle_gamma 90.0000000000
 
_symmetry_space_group_name_H-M "P -4 n 2"
_symmetry_Int_Tables_number 118
 
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,-y,z
3 -y+1/2,-x+1/2,-z+1/2
4 y+1/2,x+1/2,-z+1/2
5 -x+1/2,y+1/2,z+1/2
6 x+1/2,-y+1/2,z+1/2
7 y,-x,-z
8 -y,x,-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
In1 In   4 e 0.00000 0.00000 0.23700 1.00000
Ru1 Ru   4 f 0.15000 0.35000 0.25000 1.00000
In2 In   8 i 0.34300 0.14900 0.50900 1.00000
