data_global _chemical_name_mineral 'Svenekite' loop_ _publ_author_name 'Ondrus P' 'Skala R' 'Plasil J' 'Sejkora J' 'Veselovsky F' 'Cejka J' 'Kallistova A' 'Hlousek J' 'Fejfarova K' 'Skoda R' 'Dusek M' 'Gabasova A' 'Machovic V' 'Lapcak L' _journal_name_full 'Mineralogical Magazine' _journal_volume 77 _journal_year 2013 _journal_page_first 2711 _journal_page_last 2724 _publ_section_title ; Svenekite, Ca[AsO2(OH)2]2. a new mineral from Jachymov, Czech Republic ; _database_code_amcsd 0019984 _chemical_compound_source 'Jachymov, Czech Republic' _chemical_formula_sum 'Ca As2 O8 H4' _cell_length_a 8.5606 _cell_length_b 7.6926 _cell_length_c 5.7206 _cell_angle_alpha 92.605 _cell_angle_beta 109.9002 _cell_angle_gamma 109.9017 _cell_volume 327.479 _exptl_crystal_density_diffrn 3.265 _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 Ca 0.08168 0.18648 0.31266 0.01270 As1 0.34172 0.23993 0.98495 0.01135 As2 -0.18668 0.23399 0.66951 0.01220 O1 -0.17440 -0.06180 -0.00280 0.01490 O2 0.37710 0.40010 0.23620 0.02070 O3 0.54160 0.20790 0.07500 0.02110 O4 0.31160 0.32520 0.72130 0.01520 O5 -0.04570 0.32920 -0.03040 0.01680 O6 -0.12540 0.09350 0.52440 0.01440 O7 -0.16910 0.43390 0.53440 0.02060 O8 -0.39740 0.14120 0.65880 0.01860 H2 -0.22900 0.41000 0.43100 0.02480 H3 0.44900 0.46300 0.25300 0.02480 H5 0.55900 0.20200 0.98300 0.02530 H7 0.00000 0.50000 0.00000 0.02020 H8 0.50000 0.00000 0.50000 0.02230 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 Ca 0.01190 0.01500 0.01050 0.00220 0.00410 0.00440 As1 0.00910 0.01360 0.01030 0.00190 0.00450 0.00210 As2 0.01080 0.01290 0.01260 0.00090 0.00460 0.00400 O1 0.01100 0.01500 0.01700 0.00300 0.00800 0.00000 O2 0.02000 0.02040 0.01780 -0.00420 0.01050 0.00090 O3 0.01490 0.03510 0.01680 0.00610 0.00760 0.01200 O4 0.01430 0.01590 0.01130 0.00490 0.00370 0.00150 O5 0.01970 0.01120 0.01240 -0.00100 0.00010 0.00370 O6 0.01550 0.01510 0.01530 0.00060 0.00820 0.00670 O7 0.01720 0.02320 0.01570 0.00510 0.00000 0.00680 O8 0.01170 0.02270 0.01990 -0.00420 0.00880 0.00290