data_global _chemical_name_mineral 'Arsiccioite' loop_ _publ_author_name 'Biagioni C' 'Bonaccorsi E' 'Moelo Y' 'Orlandi P' 'Bindi L' 'D'Orazio M' 'Vezzoni S' _journal_name_full 'Mineralogical Magazine' _journal_volume 78 _journal_year 2014 _journal_page_first 101 _journal_page_last 117 _publ_section_title ; Mercury-arsenic sulfosalts from the Apuan Alps (Tuscany, Italy). II. Arsiccioite, AgHg2TlAs2S6, a new mineral from the Monte Arsiccio mine: occurrence, crystal structure and crystal chemistry of the routhierite isotypic series Note: sample A ; _database_code_amcsd 0020024 _chemical_compound_source 'Monte Arsiccio mine, Apuan Alps, Tuscany, Italy' _chemical_formula_sum 'Tl1.64 Hg1.91 Ag.88 Cu.13 Zn.08 (As1.58 Sb.42) S6' _cell_length_a 10.1386 _cell_length_b 10.1386 _cell_length_c 11.3441 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 1166.074 _exptl_crystal_density_diffrn 6.771 _symmetry_space_group_name_H-M 'I -4 2 m' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,1/2+z' '-y,-x,z' '1/2-y,1/2-x,1/2+z' 'y,-x,-z' '1/2+y,1/2-x,1/2-z' '-x,y,-z' '1/2-x,1/2+y,1/2-z' '-x,-y,z' '1/2-x,1/2-y,1/2+z' 'y,x,z' '1/2+y,1/2+x,1/2+z' '-y,x,-z' '1/2-y,1/2+x,1/2-z' 'x,-y,-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 _atom_site_occupancy _atom_site_U_iso_or_equiv Tl1 0.00000 0.00000 0.34500 0.36000 0.04300 Tl2 0.02600 -0.02600 0.35880 0.64000 0.04300 HgM1 0.00000 0.50000 0.75000 0.65000 0.03960 AgM1 0.00000 0.50000 0.75000 0.14000 0.03960 CuM1 0.00000 0.50000 0.75000 0.13000 0.03960 ZnM1 0.00000 0.50000 0.75000 0.08000 0.03960 HgM2 0.22008 0.50000 0.50000 0.63000 0.03390 AgM2 0.22008 0.50000 0.50000 0.37000 0.03390 As 0.25816 0.25816 0.25354 0.79000 0.02250 Sb 0.25816 0.25816 0.25354 0.21000 0.02250 S1 0.09490 0.32840 0.37970 1.00000 0.02440 S2 0.12320 0.12320 0.14280 1.00000 0.02200 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 Tl1 0.05600 0.05600 0.01700 -0.01000 0.00000 0.00000 Tl2 0.05600 0.05600 0.01700 -0.01000 0.00000 0.00000 HgM1 0.02950 0.02950 0.05970 0.00000 0.00000 0.00000 AgM1 0.02950 0.02950 0.05970 0.00000 0.00000 0.00000 CuM1 0.02950 0.02950 0.05970 0.00000 0.00000 0.00000 ZnM1 0.02950 0.02950 0.05970 0.00000 0.00000 0.00000 HgM2 0.04520 0.03270 0.02380 0.00000 0.00000 -0.00500 AgM2 0.04520 0.03270 0.02380 0.00000 0.00000 -0.00500 As 0.02350 0.02350 0.02040 0.00310 -0.00320 -0.00320 Sb 0.02350 0.02350 0.02040 0.00310 -0.00320 -0.00320 S1 0.02600 0.02600 0.02100 -0.00200 0.00500 -0.00800 S2 0.02500 0.02500 0.01600 -0.00200 -0.00300 -0.00300