data_global
_chemical_name_mineral 'Calcium'
loop_
_publ_author_name
'Schottmiller J C'
'King A J'
'Kanda F A'
_journal_name_full 'Journal of Physical Chemistry'
_journal_volume 62 
_journal_year 1958
_journal_page_first 1446
_journal_page_last 1449
_publ_section_title
;
 The calcium-strontium metal phase system
 Sample: at T = 415 C
;
_database_code_amcsd 0013146
_chemical_compound_source 'Synthetic'
_chemical_formula_sum 'Ca'
_cell_length_a 4.00
_cell_length_b 4.00
_cell_length_c 6.50
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 90.067
_exptl_crystal_density_diffrn      1.478
_symmetry_space_group_name_H-M 'P 63/m m c'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,-x+y,1/2+z'
  'x,x-y,1/2-z'
  '-x+y,-x,1/2-z'
  'x-y,x,1/2+z'
  '-y,-x,z'
  'y,x,-z'
  'y,-x+y,-z'
  '-y,x-y,z'
  'x-y,-y,1/2+z'
  '-x+y,y,1/2-z'
  'x,y,1/2-z'
  '-x,-y,1/2+z'
  'x,x-y,z'
  '-x,-x+y,-z'
  'x-y,x,-z'
  '-x+y,-x,z'
  'y,x,1/2+z'
  '-y,-x,1/2-z'
  '-y,x-y,1/2-z'
  'y,-x+y,1/2+z'
  '-x+y,y,z'
  'x-y,-y,-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ca   0.33333   0.66667   0.25000