# CIF file
data_findsym-output
_audit_creation_method FINDSYM

_chemical_name_mineral 'CdAs2'
_chemical_formula_sum 'As2 Cd'

loop_
_publ_author_name
 'V. N. Yakimovich'
 'V. A. Rubtsov'
 'V. M. Trukhan'
_journal_name_full_name
;
 Inorganic Materials
;
_journal_volume 32
_journal_year 1996
_journal_page_first 579
_journal_page_last 582
_publ_Section_title
;
 Phase Relationships in the CdP$_{4}$-ZnP$_{2}$-CdAs$_{2}$-ZnAs$_{2}$ System
;

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

_aflow_title 'CdAs$_{2}$ Structure'
_aflow_proto 'A2B_tI12_98_f_a'
_aflow_params 'a,c/a,x_{2}'
_aflow_params_values '7.953376649,0.587954231111,0.44'
_aflow_Strukturbericht 'None'
_aflow_Pearson 'tI12'

_cell_length_a    7.9533766490
_cell_length_b    7.9533766490
_cell_length_c    4.6762214524
_cell_angle_alpha 90.0000000000
_cell_angle_beta  90.0000000000
_cell_angle_gamma 90.0000000000
 
_symmetry_space_group_name_H-M "I 41 2 2"
_symmetry_Int_Tables_number 98
 
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 x,-y+1/2,-z+1/4
3 -x,y+1/2,-z+1/4
4 -x,-y,z
5 -y,-x,-z
6 -y,x+1/2,z+1/4
7 y,-x+1/2,z+1/4
8 y,x,-z
9 x+1/2,y+1/2,z+1/2
10 x+1/2,-y,-z+3/4
11 -x+1/2,y,-z+3/4
12 -x+1/2,-y+1/2,z+1/2
13 -y+1/2,-x+1/2,-z+1/2
14 -y+1/2,x,z+3/4
15 y+1/2,-x,z+3/4
16 y+1/2,x+1/2,-z+1/2
 
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
Cd1 Cd   4 a 0.00000 0.00000 0.00000 1.00000
As1 As   8 f 0.44000 0.25000 0.12500 1.00000
