data_global _chemical_name_mineral 'Holmquistite' loop_ _publ_author_name 'Camara F' 'Oberti R' _journal_name_full 'American Mineralogist' _journal_volume 90 _journal_year 2005 _journal_page_first 1167 _journal_page_last 1176 _publ_section_title ; The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Uto, Sweden ; _database_code_amcsd 0003817 _chemical_formula_sum 'Mg2.32 Fe1.3 Mn.06 Al1.3 Zn.01 Li1.93 Na.1 Si8 O23.87 F.13 H3.74' _cell_length_a 18.335 _cell_length_b 17.693 _cell_length_c 5.2743 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 1710.989 _exptl_crystal_density_diffrn 3.092 _symmetry_space_group_name_H-M 'P n m a' loop_ _space_group_symop_operation_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 _atom_site_U_iso_or_equiv Mg1 0.12520 0.16000 0.39490 0.77000 0.00600 Fe1 0.12520 0.16000 0.39490 0.20000 0.00600 Mn1 0.12520 0.16000 0.39490 0.03000 0.00600 Al2 0.12530 0.06850 -0.10430 0.65000 0.00300 Fe3+2 0.12530 0.06850 -0.10430 0.34000 0.00300 Fe++2 0.12530 0.06850 -0.10430 0.00500 0.00300 Zn2 0.12530 0.06850 -0.10430 0.00500 0.00300 Mg3 0.12540 0.25000 -0.10500 0.78000 0.00500 Fe3 0.12540 0.25000 -0.10500 0.21000 0.00500 Li3 0.12540 0.25000 -0.10500 0.01000 0.00500 Li4 0.12320 -0.00580 0.39780 0.96000 0.01300 Na4 0.12320 -0.00580 0.39780 0.04000 0.01300 NaA 0.37500 0.25000 0.50000 0.02000 ? Si1A 0.26970 0.16260 0.06760 1.00000 0.00400 Si1B -0.01900 0.16310 0.72470 1.00000 0.00400 Si2A 0.27330 0.07670 0.57270 1.00000 0.00400 Si2B -0.02410 0.07790 0.21760 1.00000 0.00400 O1A 0.18120 0.15850 0.05250 1.00000 0.00600 O1B 0.06940 0.15770 0.73750 1.00000 0.00500 O2A 0.18480 0.07640 0.58780 1.00000 0.00600 O2B 0.06460 0.07560 0.20270 1.00000 0.00500 O-H3A 0.18220 0.25000 0.55550 0.93500 0.00700 F3A 0.18220 0.25000 0.55550 0.06500 0.00700 O-H3B 0.06880 0.25000 0.23500 0.93500 0.00700 F3B 0.06880 0.25000 0.23500 0.06500 0.00700 O4A 0.31170 -0.00390 0.56480 1.00000 0.00800 O4B -0.06430 -0.00040 0.27040 1.00000 0.00700 O5A 0.30500 0.11600 -0.16670 1.00000 0.00700 O5B -0.05360 0.11390 0.95140 1.00000 0.00600 O6A 0.29750 0.12910 0.33400 1.00000 0.00600 O6B -0.04660 0.13440 0.45130 1.00000 0.00800 O7A 0.29460 0.25000 0.04470 1.00000 0.00900 O7B -0.04410 0.25000 0.75930 1.00000 0.00800 HA 0.23750 0.25000 0.53650 0.93500 ? HB 0.00940 0.25000 0.23550 0.93500 ?