# generated using pymatgen data_Zr2Sc2ReTc7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.23863709 _cell_length_b 5.23863833 _cell_length_c 8.56875925 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000462 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2Sc2ReTc7 _chemical_formula_sum 'Zr2 Sc2 Re1 Tc7' _cell_volume 203.65040679 _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 Zr Zr0 1 0.33333300 0.66666700 0.43677382 1.0 Zr Zr1 1 0.66666700 0.33333300 0.93660666 1.0 Sc Sc2 1 0.66666700 0.33333300 0.56247198 1.0 Sc Sc3 1 0.33333300 0.66666700 0.06259105 1.0 Re Re4 1 0.00000000 0.00000000 0.00063965 1.0 Tc Tc5 1 0.65568094 0.82784097 0.74998281 1.0 Tc Tc6 1 0.34446070 0.17222985 0.24995987 1.0 Tc Tc7 1 0.82777015 0.17222985 0.24995987 1.0 Tc Tc8 1 0.17215903 0.34431906 0.74998281 1.0 Tc Tc9 1 0.17215903 0.82784097 0.74998281 1.0 Tc Tc10 1 0.82777015 0.65553930 0.24995987 1.0 Tc Tc11 1 0.00000000 0.00000000 0.50109180 1.0