# generated using pymatgen data_CsVCuF6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.50269341 _cell_length_b 7.50269341 _cell_length_c 7.50269341 _cell_angle_alpha 122.35182194 _cell_angle_beta 118.96324540 _cell_angle_gamma 88.89039208 _symmetry_Int_Tables_number 1 _chemical_formula_structural CsVCuF6 _chemical_formula_sum 'Cs2 V2 Cu2 F12' _cell_volume 295.27300564 _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 Cs Cs0 1 0.37156300 0.62156300 0.75000000 1.0 Cs Cs1 1 0.62843700 0.37843700 0.25000000 1.0 V V2 1 0.00000000 0.00000000 0.00000000 1.0 V V3 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu4 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu5 1 0.00000000 0.50000000 0.00000000 1.0 F F6 1 0.31232500 0.06232500 0.25000000 1.0 F F7 1 0.93369400 0.68369400 0.25000000 1.0 F F8 1 0.33172000 0.68531300 0.26057100 1.0 F F9 1 0.92474200 0.07114900 0.23942900 1.0 F F10 1 0.33172000 0.07114900 0.64640700 1.0 F F11 1 0.92474200 0.68531300 0.85359300 1.0 F F12 1 0.68767500 0.93767500 0.75000000 1.0 F F13 1 0.06630600 0.31630600 0.75000000 1.0 F F14 1 0.66828000 0.31468700 0.73942900 1.0 F F15 1 0.07525800 0.92885100 0.76057100 1.0 F F16 1 0.66828000 0.92885100 0.35359300 1.0 F F17 1 0.07525800 0.31468700 0.14640700 1.0