# generated using pymatgen data_Sc5(Re7Tc5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.39442144 _cell_length_b 8.39442074 _cell_length_c 8.39316223 _cell_angle_alpha 109.48721882 _cell_angle_beta 109.48722587 _cell_angle_gamma 109.55641080 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5(Re7Tc5)2 _chemical_formula_sum 'Sc5 Re14 Tc10' _cell_volume 454.62712645 _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 Sc Sc0 1 0.99943763 0.99943763 0.99977754 1.0 Sc Sc1 1 0.62952560 0.99986936 0.00015141 1.0 Sc Sc2 1 0.99986936 0.62952560 0.00015141 1.0 Sc Sc3 1 0.99951458 0.99951458 0.62922713 1.0 Sc Sc4 1 0.37000276 0.37000276 0.36799907 1.0 Re Re5 1 0.27787303 0.60274782 0.60283769 1.0 Re Re6 1 0.60274782 0.27787303 0.60283769 1.0 Re Re7 1 0.37783306 0.19262173 0.99959901 1.0 Re Re8 1 0.18460657 0.80832996 0.80841668 1.0 Re Re9 1 0.37832976 0.00113280 0.19375517 1.0 Re Re10 1 0.19262173 0.37783306 0.99959901 1.0 Re Re11 1 0.00113280 0.37832976 0.19375517 1.0 Re Re12 1 0.80832996 0.18460657 0.80841668 1.0 Re Re13 1 0.80740150 0.80740150 0.18526470 1.0 Re Re14 1 0.00060339 0.19303029 0.37819533 1.0 Re Re15 1 0.19303029 0.00060339 0.37819533 1.0 Re Re16 1 0.62125938 0.62125938 0.81361250 1.0 Re Re17 1 0.81350134 0.62136200 0.62146734 1.0 Re Re18 1 0.62136200 0.81350134 0.62146734 1.0 Tc Tc19 1 0.39784252 0.67663179 0.00037486 1.0 Tc Tc20 1 0.72180078 0.32368995 0.32329972 1.0 Tc Tc21 1 0.39790131 0.00014527 0.67601945 1.0 Tc Tc22 1 0.67663179 0.39784252 0.00037486 1.0 Tc Tc23 1 0.00014527 0.39790131 0.67601945 1.0 Tc Tc24 1 0.32368995 0.72180078 0.32329972 1.0 Tc Tc25 1 0.32375332 0.32375332 0.72199235 1.0 Tc Tc26 1 0.00039444 0.67630171 0.39801934 1.0 Tc Tc27 1 0.67630171 0.00039444 0.39801934 1.0 Tc Tc28 1 0.60255735 0.60255735 0.27785068 1.0