#------------------------------------------------------------------------------ #$Date: 2009-11-14 15:09:05 +0200 (Sat, 14 Nov 2009) $ #$Revision: 846 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/1100049.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. # # Crystal Data data_global _journal_name_full 'Z. Kristallogr. A' _journal_volume 96 _chemical_formula_sum 'Al8 Cr5' _chemical_name_structure_type 'Al8Cr5' # Publication Data loop_ _publ_author_name 'A.J.Bradley & S.S.Lu' _journal_year 1937 _journal_page_first 20 # Unit Cell Data _cell_length_a 7.805 _cell_length_b 7.805 _cell_length_c 7.805 _cell_angle_alpha 109.127 _cell_angle_beta 109.127 _cell_angle_gamma 109.127 _cell_volume 370.60 _cell_formula_units_Z 2 # Space Group _symmetry_space_group_name_H-M 'R 3 m' _symmetry_Int_Tables_number 160 _symmetry_cell_setting rhombohedral loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' 'z,x,y' 'y,z,x' 'y,x,z' 'x,z,y' 'z,y,x' # Atomic Coordinates loop_ _atom_site_label _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_type_symbol Cr1 1 a 0.1940 0.1940 0.1940 1.0000 Cr Cr2 3 b 0.0030 0.0030 0.7940 1.0000 Cr Cr3 3 b 0.9980 0.9980 0.3400 1.0000 Cr Cr4 3 b 0.3550 0.3550 0.0060 1.0000 Cr Al1 1 a 0.6720 0.6720 0.6720 1.0000 Al Al2 3 b 0.6540 0.6540 0.0120 1.0000 Al Al3 3 b 0.3490 0.3490 0.5820 1.0000 Al Al4 3 b 0.7220 0.7220 0.3560 1.0000 Al Al5 6 c 0.0330 0.2880 0.6610 1.0000 Al