data_global
_chemical_name_mineral 'Joelbruggerite'
loop_
_publ_author_name
'Mills S J'
'Kolitsch U'
'Miyawaki R'
'Groat L A'
'Poirier G'
_journal_name_full 'American Mineralogist'
_journal_volume 94 
_journal_year 2009
_journal_page_first 1012
_journal_page_last 1017
_publ_section_title
;
 Joelbruggerite, Pb3Zn3(Sb,Te)As2O13(OH,O), the Sb5+ analog of dugganite,
 from the Black Pine mine, Montana
;
_database_code_amcsd 0004959
_chemical_compound_source 'the Black Pine mine, Montana, USA'
_chemical_formula_sum 'Pb3 (Sb.57 Te.43) Zn3 As2 O14'
_cell_length_a 8.4803
_cell_length_b 8.4803
_cell_length_c 5.2334
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 325.939
_exptl_crystal_density_diffrn      6.704
_symmetry_space_group_name_H-M 'P 3 2 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'y,x,-z'
  '-y,x-y,z'
  '-x,-x+y,-z'
  '-x+y,-x,z'
  'x-y,-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
Pb   0.40396   0.00000   0.00000   1.00000   0.02610
Sb   0.00000   0.00000   0.00000   0.57000   0.01820
Te   0.00000   0.00000   0.00000   0.43000   0.01820
Zn   0.00000  -0.24500   0.50000   1.00000   0.02480
As   0.33333   0.66667   0.47380   1.00000   0.02150
O1  -0.12700  -0.21800   0.21200   1.00000   0.04000
O2  -0.20200  -0.46000   0.66900   1.00000   0.05500
O3   0.33333   0.66667  -0.20400   1.00000   0.02300
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Pb 0.03090 0.02700 0.01910 0.01350 -0.00121 -0.00240
Sb 0.02260 0.02260 0.00930 0.01130 0.00000 0.00000
Te 0.02260 0.02260 0.00930 0.01130 0.00000 0.00000
Zn 0.02150 0.03330 0.01580 0.01070 -0.00030 -0.00010
As 0.01880 0.01880 0.02700 0.00940 0.00000 0.00000
O1 0.04300 0.04300 0.03000 0.01800 -0.00100 0.01200
O2 0.05600 0.05500 0.03800 0.01500 0.00700 0.00000
O3 0.02400 0.02400 0.02100 0.01200 0.00000 0.00000