data_global _chemical_name_mineral 'Sinnerite' loop_ _publ_author_name 'Bindi L' 'Makovicky E' 'Nestola F' 'Battisti L D' _journal_name_full 'The Canadian Mineralogist' _journal_volume 51 _journal_year 2013 _journal_page_first 851 _journal_page_last 860 _publ_section_title ; Sinnerite, Cu6As4S9, from the Lengenbach Quarry, Binn Valley, Switzerland: Description and re-investigation of the crystal structure ; _database_code_amcsd 0020208 _chemical_compound_source 'Lengenbach Quarry, Binn Valley, Switzerland' _chemical_formula_sum 'Cu6 As4 S9' _cell_length_a 9.103 _cell_length_b 9.860 _cell_length_c 9.111 _cell_angle_alpha 90.27 _cell_angle_beta 109.53 _cell_angle_gamma 107.58 _cell_volume 729.618 _exptl_crystal_density_diffrn 4.413 _symmetry_space_group_name_H-M 'P 1' loop_ _space_group_symop_operation_xyz '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 0.77700 0.64400 0.13000 0.03600 Cu2 0.34000 0.45000 -0.01000 0.02300 Cu3 0.47100 0.84000 0.02700 0.01400 Cu4 0.02200 0.64900 0.88000 0.02900 Cu5 0.97500 0.84500 0.51700 0.01600 Cu6 0.82700 0.46000 0.49000 0.02300 Cu7 0.13700 0.24500 0.57100 0.02500 Cu8 0.89800 0.24400 0.86200 0.02000 Cu9 0.68100 0.04100 0.43700 0.03600 Cu10 0.44000 0.04700 0.68900 0.02200 Cu11 0.62400 0.24200 0.09700 0.02900 Cu12 0.07500 0.43400 0.22500 0.02400 As1 0.37600 0.23400 0.32600 0.01900 As2 0.19200 0.05700 -0.03600 0.01000 As3 0.95900 0.06200 0.18800 0.01300 As4 0.22500 0.84500 0.27500 0.02100 As5 0.53400 0.64100 0.39400 0.02700 As6 0.29100 0.62600 0.63800 0.01000 As7 0.58900 0.46200 0.73400 0.03700 As8 0.73700 0.84900 0.79000 0.02400 S1 0.27600 0.65500 0.88600 0.01600 S2 0.47800 0.83200 0.30100 0.01400 S3 0.88400 0.24400 0.10700 0.01500 S4 0.70700 0.04700 0.69100 0.01800 S5 0.40500 0.24700 0.59800 0.02100 S6 0.76900 0.65200 0.37600 0.02300 S7 0.06100 0.43200 0.47100 0.03700 S8 -0.00200 0.86500 0.79100 0.01400 S9 0.62100 0.22600 0.33200 0.01700 S10 0.83600 0.45100 0.74100 0.02700 S11 0.23200 0.84500 0.51900 0.03500 S12 0.13400 0.24100 0.81400 0.01600 S13 0.93200 0.04300 0.41200 0.01400 S14 0.73300 0.86800 0.03500 0.01900 S15 0.32600 0.44100 0.24200 0.01800 S16 0.01700 0.63800 0.13200 0.02100 S17 0.42800 0.05100 0.94800 0.01800 S18 0.58500 0.43400 -0.01100 0.02000