data_global _chemical_name_mineral 'Pargasite' loop_ _publ_author_name 'Makino K' 'Tomita K' _journal_name_full 'American Mineralogist' _journal_volume 74 _journal_year 1989 _journal_page_first 1097 _journal_page_last 1105 _publ_section_title ; Cation distribution in the octahedral sites of hornblendes sample I-P from Iratsu, Japan ; _database_code_amcsd 0001267 _chemical_formula_sum '(Si6.2 Al1.8) Mg3.343 Fe1.771 Ca1.702 Na3.384 O24 H2' _cell_length_a 9.805 _cell_length_b 17.96 _cell_length_c 5.302 _cell_angle_alpha 90 _cell_angle_beta 104.93 _cell_angle_gamma 90 _cell_volume 902.151 _exptl_crystal_density_diffrn 3.442 _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 Si1 0.28090 0.08580 0.30140 0.57000 0.00608 Al1 0.28090 0.08580 0.30140 0.43000 0.00608 Si2 0.29190 0.17310 0.81330 0.98000 0.00608 Al2 0.29190 0.17310 0.81330 0.02000 0.00608 Mg1 0.00000 0.08860 0.50000 0.61500 0.00988 Fe1 0.00000 0.08860 0.50000 0.38500 0.00988 Mg2 0.00000 0.17720 0.00000 0.81600 0.00621 Fe2 0.00000 0.17720 0.00000 0.18400 0.00621 Mg3 0.00000 0.00000 0.00000 0.48100 0.00785 Fe3 0.00000 0.00000 0.00000 0.51900 0.00785 Ca4 0.00000 0.27890 0.50000 0.85100 0.01013 Na4 0.00000 0.27890 0.50000 0.09200 0.01013 Fe4 0.00000 0.27890 0.50000 0.05700 0.01013 NaAm 0.04740 0.50000 0.10140 0.80000 0.03420 NaA2 0.00000 0.47740 0.00000 0.80000 0.02736 O1 0.10700 0.08960 0.21450 1.00000 0.01203 O2 0.12040 0.17420 0.73660 1.00000 0.00975 O-H3 0.11010 0.00000 0.71400 1.00000 0.01089 O4 0.36840 0.25010 0.78950 1.00000 0.01165 O5 0.35000 0.14040 0.10840 1.00000 0.01115 O6 0.34270 0.11810 0.60720 1.00000 0.01279 O7 0.33800 0.00000 0.27650 1.00000 0.01558