#------------------------------------------------------------------------------ #$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $ #$Revision: 19 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9004150.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_9004150 _chemical_name 'Weibullite' loop_ _publ_author_name 'Mumme W G' _journal_name_full "The Canadian Mineralogist" _journal_volume 18 _journal_year 1980 _journal_page_first 1 _journal_page_last 12 _publ_section_title ; Weibullite Ag0.32Pb5.09Bi8.55Se6.08S11.92 from Falun, Sweden: A higher homologue of galenobismutite Locality: Falun, Sweden ; _chemical_formula_sum 'Pb5.33 Bi8.34 Ag.33 S15.03 Se2.97' _cell_length_a 53.68 _cell_length_b 4.11 _cell_length_c 15.40 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 3397.622 _symmetry_space_group_name_H-M 'P n m a' loop_ _symmetry_equiv_pos_as_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_occupancy PbMe1 0.05150 0.25000 0.36310 1.00000 BiMe2 0.11700 0.75000 0.35250 1.00000 BiMe3 0.18220 0.25000 0.33230 1.00000 PbMe4 0.25240 0.75000 0.28450 1.00000 BiMe5 0.28940 0.25000 0.05800 1.00000 BiMe6 0.35630 0.75000 0.07680 1.00000 BiMe7 0.42120 0.25000 0.09740 1.00000 BiMe8 0.48650 0.75000 0.10910 1.00000 PbMe9 0.05960 0.75000 0.06480 1.00000 PbMe10 0.13960 0.75000 0.08270 1.00000 PbMe11 0.21950 0.75000 0.03110 0.33000 BiMe11 0.21950 0.75000 0.03110 0.34000 AgMe11 0.21950 0.75000 0.03110 0.33000 BiMe12 0.32870 0.75000 0.36410 1.00000 PbMe13 0.40420 0.75000 0.36670 1.00000 BiMe14 0.48370 0.75000 0.38480 1.00000 S1 0.03320 0.75000 0.49050 1.00000 S2 0.09600 0.25000 0.47150 1.00000 S3 0.16340 0.75000 0.45490 1.00000 S4 0.23000 0.25000 0.43250 0.67000 Se4 0.23000 0.25000 0.43250 0.33000 S5 0.00390 0.25000 0.28020 0.67000 Se5 0.00390 0.25000 0.28020 0.33000 S6 0.07210 0.75000 0.26300 0.67000 Se6 0.07210 0.75000 0.26300 0.33000 S7 0.13400 0.25000 0.23970 0.67000 Se7 0.13400 0.25000 0.23970 0.33000 S8 0.19870 0.75000 0.22710 0.67000 Se8 0.19870 0.75000 0.22710 0.33000 S9 0.31080 0.75000 0.16110 0.67000 Se9 0.31080 0.75000 0.16110 0.33000 S10 0.37620 0.25000 0.18720 0.67000 Se10 0.37620 0.25000 0.18720 0.33000 S11 0.44210 0.75000 0.20010 0.67000 Se11 0.44210 0.75000 0.20010 0.33000 S12 0.17580 0.25000 0.04330 1.00000 S13 0.02420 0.25000 0.05060 1.00000 S14 0.09590 0.25000 0.05950 0.67000 Se14 0.09590 0.25000 0.05950 0.33000 S15 0.24750 0.25000 0.14170 1.00000 S16 0.44480 0.25000 0.37920 1.00000 S17 0.29460 0.25000 0.35340 1.00000 S18 0.36580 0.25000 0.40090 1.00000