# generated using pymatgen data_Fe2Re3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.43019807 _cell_length_b 6.43020859 _cell_length_c 6.43021257 _cell_angle_alpha 89.99942252 _cell_angle_beta 90.00032068 _cell_angle_gamma 89.99955056 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe2Re3 _chemical_formula_sum 'Fe8 Re12' _cell_volume 265.87330981 _cell_formula_units_Z 4 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 Fe Fe0 1 0.18937295 0.81065000 0.31060660 1.0 Fe Fe1 1 0.31064002 0.18935473 0.81063210 1.0 Fe Fe2 1 0.81062975 0.31060990 0.18933059 1.0 Fe Fe3 1 0.68935630 0.68936637 0.68936525 1.0 Fe Fe4 1 0.56064966 0.43935236 0.93935418 1.0 Fe Fe5 1 0.43938848 0.93936684 0.56062778 1.0 Fe Fe6 1 0.93935376 0.56061747 0.43934983 1.0 Fe Fe7 1 0.06062516 0.06064571 0.06060828 1.0 Re Re8 1 0.80107613 0.94896064 0.37503688 1.0 Re Re9 1 0.69894578 0.05103567 0.87503755 1.0 Re Re10 1 0.19893456 0.44893473 0.12498115 1.0 Re Re11 1 0.30104550 0.55107293 0.62502098 1.0 Re Re12 1 0.94898164 0.37504046 0.80106806 1.0 Re Re13 1 0.05107809 0.87500031 0.69893915 1.0 Re Re14 1 0.44891778 0.12503415 0.19896180 1.0 Re Re15 1 0.55102707 0.62495891 0.30106909 1.0 Re Re16 1 0.37504921 0.80109630 0.94895927 1.0 Re Re17 1 0.87496777 0.69898363 0.05107011 1.0 Re Re18 1 0.12496034 0.19889756 0.44893962 1.0 Re Re19 1 0.62500106 0.30102332 0.55104073 1.0