# generated using pymatgen data_Cr8Cd3CuS16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.41154315 _cell_length_b 12.41154315 _cell_length_c 12.41154416 _cell_angle_alpha 33.89914245 _cell_angle_beta 33.89914245 _cell_angle_gamma 33.89914289 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr8Cd3CuS16 _chemical_formula_sum 'Cr8 Cd3 Cu1 S16' _cell_volume 530.05114676 _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 0.56617300 0.06299300 0.56617300 1.0 Cr Cr1 1 0.06186200 0.55810600 0.06186200 1.0 Cr Cr2 1 0.06299300 0.56617300 0.56617300 1.0 Cr Cr3 1 0.55810600 0.06186200 0.06186200 1.0 Cr Cr4 1 0.80937500 0.80937500 0.80937500 1.0 Cr Cr5 1 0.31270000 0.31270000 0.31270000 1.0 Cr Cr6 1 0.56617300 0.56617300 0.06299300 1.0 Cr Cr7 1 0.06186200 0.06186200 0.55810600 1.0 Cd Cd8 1 0.62527800 0.62527800 0.62527800 1.0 Cd Cd9 1 0.00054900 0.00054900 0.00054900 1.0 Cd Cd10 1 0.50101100 0.50101100 0.50101100 1.0 Cu Cu11 1 0.12477800 0.12477800 0.12477800 1.0 S S12 1 0.21267500 0.64800000 0.21267500 1.0 S S13 1 0.71079700 0.14543800 0.71079700 1.0 S S14 1 0.64800000 0.21267500 0.21267500 1.0 S S15 1 0.14543800 0.71079700 0.71079700 1.0 S S16 1 0.43051300 0.43051300 0.43051300 1.0 S S17 1 0.92868900 0.92868900 0.92868900 1.0 S S18 1 0.21267500 0.21267500 0.64800000 1.0 S S19 1 0.71079700 0.71079700 0.14543800 1.0 S S20 1 0.92616000 0.45654000 0.92616000 1.0 S S21 1 0.41287200 0.97646700 0.41287200 1.0 S S22 1 0.45654000 0.92616000 0.92616000 1.0 S S23 1 0.97646700 0.41287200 0.41287200 1.0 S S24 1 0.69731300 0.69731300 0.69731300 1.0 S S25 1 0.19117100 0.19117100 0.19117100 1.0 S S26 1 0.92616000 0.92616000 0.45654000 1.0 S S27 1 0.41287200 0.41287200 0.97646700 1.0