# generated using pymatgen data_Zr3V2(ReMo)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.26486601 _cell_length_b 5.27055234 _cell_length_c 13.00120345 _cell_angle_alpha 89.95124248 _cell_angle_beta 90.05492151 _cell_angle_gamma 119.91438059 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3V2(ReMo)2 _chemical_formula_sum 'Zr6 V4 Re4 Mo4' _cell_volume 312.70256610 _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 Zr Zr0 1 0.33400277 0.66666003 0.91871497 1.0 Zr Zr1 1 0.00103275 0.99998921 0.24721435 1.0 Zr Zr2 1 0.66660022 0.33250910 0.58333944 1.0 Zr Zr3 1 0.33280378 0.66773933 0.66791651 1.0 Zr Zr4 1 0.99989773 0.00018971 0.00126363 1.0 Zr Zr5 1 0.66603362 0.33353674 0.33132723 1.0 V V6 1 0.66666628 0.33152789 0.95870910 1.0 V V7 1 0.99915683 0.49895862 0.12313344 1.0 V V8 1 0.66618139 0.83333478 0.45772846 1.0 V V9 1 0.33464845 0.16752605 0.79413354 1.0 Re Re10 1 0.50189158 0.49882639 0.12239177 1.0 Re Re11 1 0.16594417 0.83345467 0.45797238 1.0 Re Re12 1 0.83199259 0.16762230 0.79479790 1.0 Re Re13 1 0.50200023 0.00204568 0.12259097 1.0 Mo Mo14 1 0.16594980 0.33292051 0.45794955 1.0 Mo Mo15 1 0.83200468 0.66509365 0.79438478 1.0 Mo Mo16 1 0.33421578 0.66780082 0.29055080 1.0 Mo Mo17 1 0.99897934 0.00026152 0.62588016 1.0