# generated using pymatgen data_V2CuS4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.94402600 _cell_length_b 6.96446237 _cell_length_c 6.96446237 _cell_angle_alpha 60.54848320 _cell_angle_beta 60.09702109 _cell_angle_gamma 60.09702109 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2CuS4 _chemical_formula_sum 'V4 Cu2 S8' _cell_volume 239.48599209 _cell_formula_units_Z 2 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 V V0 1 0.01624800 0.25269400 0.25269400 1.0 V V1 1 0.47836500 0.25269400 0.25269400 1.0 V V2 1 0.50626900 0.23061600 0.75684600 1.0 V V3 1 0.50626900 0.75684600 0.23061600 1.0 Cu Cu4 1 0.12572900 0.87427100 0.87427100 1.0 Cu Cu5 1 0.87412800 0.62587200 0.62587200 1.0 S S6 1 0.25390800 0.00591600 0.00591600 1.0 S S7 1 0.73426000 0.00591600 0.00591600 1.0 S S8 1 0.73997000 0.49345100 0.49345100 1.0 S S9 1 0.27312800 0.49345100 0.49345100 1.0 S S10 1 0.74548900 0.02269300 0.48632800 1.0 S S11 1 0.74548900 0.48632800 0.02269300 1.0 S S12 1 0.25637400 0.00076000 0.48649200 1.0 S S13 1 0.25637400 0.48649200 0.00076000 1.0