# generated using pymatgen data_AgAsS _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.96897100 _cell_length_b 6.08320600 _cell_length_c 12.12033900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural AgAsS _chemical_formula_sum 'Ag4 As4 S4' _cell_volume 292.63429144 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ag Ag0 1 0.25000000 0.93409300 0.83154300 1.0 Ag Ag1 1 0.25000000 0.56590700 0.33154300 1.0 Ag Ag2 1 0.75000000 0.43409300 0.66845700 1.0 Ag Ag3 1 0.75000000 0.06590700 0.16845700 1.0 As As4 1 0.25000000 0.86464800 0.48883200 1.0 As As5 1 0.25000000 0.63535200 0.98883200 1.0 As As6 1 0.75000000 0.36464800 0.01116800 1.0 As As7 1 0.75000000 0.13535200 0.51116800 1.0 S S8 1 0.25000000 0.79734800 0.15583000 1.0 S S9 1 0.25000000 0.70265200 0.65583000 1.0 S S10 1 0.75000000 0.29734800 0.34417000 1.0 S S11 1 0.75000000 0.20265200 0.84417000 1.0