data_global
_amcsd_formula_title 'Cd2 I P3'
loop_
_publ_author_name
'Rebbah A'
'Yazbeck J'
'Lande R'
'Deschanvres A'
_journal_name_full 'Materials Research Bulletin'
_journal_volume 16 
_journal_year 1981
_journal_page_first 525
_journal_page_last 533
_publ_section_title
;
 Etudes structurales et optiques des phases du type Cd2 A3 X
 (A = As, P; X = Cl, Br, I) et de leur solution solide
 _cod_database_code 1001295
;
_database_code_amcsd 0014292
_chemical_formula_sum 'Cd2 P3 I'
_cell_length_a 8.243
_cell_length_b 9.334
_cell_length_c 7.516
_cell_angle_alpha 90
_cell_angle_beta 99.8
_cell_angle_gamma 90
_cell_volume 569.844
_exptl_crystal_density_diffrn      5.183
_symmetry_space_group_name_H-M 'C 1 c 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,z'
  'x,-y,1/2+z'
  '1/2+x,1/2-y,1/2+z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Cd1   0.00000   0.14100   0.00000
Cd2   0.50000   0.14500   0.06900
P1   0.14700   0.04300   0.32400
P2  -0.25800   0.29000   0.04000
P3   0.38800   0.04400  -0.23900
I1   0.24000   0.37400   0.06000