# generated using pymatgen data_Cr4InCuS8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.23193573 _cell_length_b 7.23193573 _cell_length_c 7.23193615 _cell_angle_alpha 58.98759711 _cell_angle_beta 58.98759711 _cell_angle_gamma 58.98759269 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr4InCuS8 _chemical_formula_sum 'Cr4 In1 Cu1 S8' _cell_volume 261.27688716 _cell_formula_units_Z 1 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 Cr Cr0 1 0.37273800 0.37273800 0.37273800 1.0 Cr Cr1 1 0.50917100 0.99673800 0.99673800 1.0 Cr Cr2 1 0.99673800 0.99673800 0.50917100 1.0 Cr Cr3 1 0.99673800 0.50917100 0.99673800 1.0 In In4 1 0.99718000 0.99718000 0.99718000 1.0 Cu Cu5 1 0.62594700 0.62594700 0.62594700 1.0 S S6 1 0.23248200 0.74505800 0.74505800 1.0 S S7 1 0.74505800 0.74505800 0.23248200 1.0 S S8 1 0.74505800 0.23248200 0.74505800 1.0 S S9 1 0.75888600 0.75888600 0.75888600 1.0 S S10 1 0.76925700 0.25502100 0.25502100 1.0 S S11 1 0.25502100 0.25502100 0.76925700 1.0 S S12 1 0.25502100 0.76925700 0.25502100 1.0 S S13 1 0.24070600 0.24070600 0.24070600 1.0