data_global
_chemical_name_mineral 'Chlorophoenicite'
loop_
_publ_author_name
'Moore P B'
_journal_name_full 'American Mineralogist'
_journal_volume 53 
_journal_year 1968
_journal_page_first 1110
_journal_page_last 1119
_publ_section_title
;
 The crystal structure of chlorophoenicite
;
_database_code_amcsd 0000179
_chemical_formula_sum '(Mn2.61 Ca.3 Mg.09) Zn2 As (O12 H8)'
_cell_length_a 22.98
_cell_length_b 3.32
_cell_length_c 7.32
_cell_angle_alpha 90
_cell_angle_beta 106.0
_cell_angle_gamma 90
_cell_volume 536.835
_exptl_crystal_density_diffrn      3.485
_symmetry_space_group_name_H-M 'C 1 2/m 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,z'
  'x,-y,z'
  '1/2+x,1/2-y,z'
  '-x,y,-z'
  '1/2-x,1/2+y,-z'
  '-x,-y,-z'
  '1/2-x,1/2-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Mn1   0.00000   0.00000   0.00000   0.87000   0.01127
Ca1   0.00000   0.00000   0.00000   0.10000   0.01127
Mg1   0.00000   0.00000   0.00000   0.03000   0.01127
Mn2   0.08880   0.50000   0.36560   0.87000   0.01583
Ca2   0.08880   0.50000   0.36560   0.10000   0.01583
Mg2   0.08880   0.50000   0.36560   0.03000   0.01583
Zn   0.20760   0.00000   0.22070   1.00000   0.01216
As   0.38230   0.00000   0.10470   0.50000   0.00646
O-H1   0.02220   0.00000   0.30020   1.00000   0.01494
O2   0.06570   0.50000   0.04300   1.00000   0.01684
O-H3   0.15610   0.00000   0.39140   1.00000   0.01178
O-H4   0.25480   0.50000   0.25870   1.00000   0.01659
O-H5   0.40590   0.00000   0.32460   1.00000   0.04534
O6   0.33940   0.50000   0.04710   1.00000   0.01786