data_global _chemical_name_mineral 'Fassinaite' loop_ _publ_author_name 'Bindi L' 'Nestola F' 'Kolitsch U' 'Guastoni A' 'Zorzi F' _journal_name_full 'Mineralogical Magazine' _journal_volume 75 _journal_year 2011 _journal_page_first 2721 _journal_page_last 2732 _publ_section_title ; Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups: description and crystal structure Note: Sample ID FAS-02 ; _database_code_amcsd 0018572 _chemical_compound_source 'Erasmus adit, Schwarzleo District, Leogang, Salzburg, Austria' _chemical_formula_sum 'Pb2 S2 C O6' _cell_length_a 16.343 _cell_length_b 8.760 _cell_length_c 4.592 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 657.412 _exptl_crystal_density_diffrn 5.926 _symmetry_space_group_name_H-M 'P n m a' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x,1/2-y,z' '-x,1/2+y,-z' '1/2-x,1/2+y,1/2+z' '1/2+x,1/2-y,1/2-z' '1/2+x,y,1/2-z' '1/2-x,-y,1/2+z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Pb 0.13571 0.48680 0.58380 0.01990 S1 0.00260 0.25000 0.07180 0.01300 C 0.71250 0.25000 0.37500 0.01400 O1 0.05980 0.25000 0.82600 0.01900 O2 0.27550 0.62190 0.50100 0.02400 O3 0.01390 0.11260 0.24800 0.01900 O4 0.18580 0.25000 0.38700 0.02200 S2 0.88530 0.25000 0.92770 0.01840 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 0.01690 0.01880 0.02390 -0.00110 -0.00110 -0.00040 S1 0.01000 0.01700 0.01200 0.00000 -0.00400 0.00000 C 0.01000 0.02000 0.01200 0.00000 -0.00500 0.00000 O1 0.01200 0.03300 0.01100 0.00000 0.00400 0.00000 O2 0.02200 0.02600 0.02300 -0.00600 0.00800 -0.01300 O3 0.01600 0.02300 0.01700 -0.00200 -0.00500 0.00500 O4 0.02500 0.02400 0.01700 0.00000 0.01400 0.00000 S2 0.01100 0.02400 0.02000 0.00000 -0.00200 0.00000