data_global _chemical_name_mineral 'Kobyashevite' loop_ _publ_author_name 'Pekov I V' 'Zubkova N V' 'Yapaskurt V O' 'Belakovskiy D I' 'Chukanov N V' 'Kasatkin A V' 'Kuznetsov A M' 'Pushcharovsky D Y' _journal_name_full 'Mineralogy and Petrology' _journal_volume 107 _journal_year 2013 _journal_page_first 201 _journal_page_last 210 _publ_section_title ; Kobyashevite, Cu5(SO4)2(OH)6*4H2O, a new devilline-group mineral from the Vishnevye Mountains, South Urals, Russia ; _database_code_amcsd 0020496 _chemical_compound_source 'Kapitalnaya mine, South Urals, Russia' _chemical_formula_sum 'Cu5 S2 O18 H14' _cell_length_a 6.0731 _cell_length_b 11.0597 _cell_length_c 5.5094 _cell_angle_alpha 102.883 _cell_angle_beta 92.348 _cell_angle_gamma 92.597 _cell_volume 359.867 _exptl_crystal_density_diffrn 3.156 _symmetry_space_group_name_H-M 'P -1' loop_ _space_group_symop_operation_xyz 'x,y,z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Cu1 0.00000 0.00000 0.00000 0.01470 Cu2 0.50000 0.00000 0.00000 0.01530 Cu3 0.75095 -0.00256 0.50483 0.01379 Cu4 0.50000 0.50000 0.00000 0.03060 S1 0.82222 0.27673 0.28630 0.01780 O1 0.73500 -0.09110 0.83620 0.01480 H1 0.71300 -0.17100 0.83800 0.01400 O2 0.50300 0.08290 0.70970 0.01500 H2 0.51200 0.16600 0.74400 0.01400 O3 0.00890 0.07910 0.71080 0.01330 H3 -0.00900 0.15990 0.75800 0.01400 O4 0.76730 0.14210 0.24720 0.01680 O5 0.96750 0.29700 0.09280 0.02770 O6 0.61840 0.34220 0.27540 0.03130 O7 0.93870 0.32130 0.53250 0.02740 O8 0.22810 0.49310 0.15090 0.03500 H81 0.13900 0.42400 0.12200 0.02600 H82 0.16500 0.55500 0.25200 0.09000 O9 0.39100 0.36240 0.70860 0.02480 H91 0.24900 0.36500 0.66300 0.05200 H92 0.48800 0.39000 0.61300 0.09000 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Cu1 0.01040 0.02320 0.01050 -0.00080 0.00130 0.00390 Cu2 0.01030 0.02350 0.01250 0.00130 0.00330 0.00440 Cu3 0.00830 0.02170 0.01110 0.00000 0.00180 0.00310 Cu4 0.02290 0.02610 0.03550 -0.00780 0.01410 -0.00900 S1 0.01810 0.01500 0.01970 0.00120 0.00510 0.00190 O1 0.01370 0.01600 0.01520 -0.00010 0.00050 0.00510 O2 0.01430 0.01800 0.01330 -0.00040 -0.00010 0.00400 O3 0.01020 0.01500 0.01340 0.00060 0.00170 0.00040 O4 0.01520 0.01500 0.02100 0.00080 0.00280 0.00490 O5 0.03340 0.02300 0.02600 -0.00460 0.01880 0.00300 O6 0.02850 0.02900 0.03900 0.01340 0.00930 0.01010 O7 0.02530 0.03000 0.02170 0.00390 0.00110 -0.00640 O8 0.02700 0.02000 0.05100 -0.00810 0.02170 -0.00700 O9 0.01490 0.02900 0.02800 -0.00290 0.00750 0.00100