data_global _chemical_name_mineral 'Hornesite' loop_ _publ_author_name 'Rojo J M' 'Mesa J L' 'Pizarro J L' 'Lezama L' 'Arriortua M I' 'Rojo T' _journal_name_full 'Materials Research Bulletin' _journal_volume 31 _journal_year 1996 _journal_page_first 925 _journal_page_last 934 _publ_section_title ; Spectroscopic and magnetic study of the (Mg,M)3(AsO4)2*8H2O (M = Ni2+, Co2+) arsenates Note: z(Wat2) corrected ; _database_code_amcsd 0014376 _chemical_compound_source 'Synthetic' _chemical_formula_sum '(Mg2.484 Ni.516) As2 O16 H16' _cell_length_a 10.2573 _cell_length_b 13.4211 _cell_length_c 4.7526 _cell_angle_alpha 90 _cell_angle_beta 105.076 _cell_angle_gamma 90 _cell_volume 631.745 _exptl_crystal_density_diffrn 2.695 _symmetry_space_group_name_H-M 'C 1 2/m 1' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,z' 'x,-y,z' '1/2+x,1/2-y,z' '-x,y,-z' '1/2-x,1/2+y,-z' '-x,-y,-z' '1/2-x,1/2-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 MgM1 0.00000 0.00000 0.00000 0.64800 0.00557 NiM1 0.00000 0.00000 0.00000 0.35200 0.00557 MgM2 0.00000 0.38390 0.00000 0.91800 0.00557 NiM2 0.00000 0.38390 0.00000 0.08200 0.00557 As 0.31540 0.00000 0.37850 1.00000 0.00557 O1 0.14980 0.00000 0.38400 1.00000 0.00557 O2 0.40650 0.00000 0.73700 1.00000 0.00557 O3 0.33700 0.11080 0.21680 1.00000 0.00557 Wat1 0.09900 0.11270 -0.18850 1.00000 0.00557 Wat2 0.40140 0.22530 0.70750 1.00000 0.00557