# generated using pymatgen data_Tm5(Si5Ir2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.52669422 _cell_length_b 12.52666957 _cell_length_c 4.20970992 _cell_angle_alpha 89.99999617 _cell_angle_beta 90.00000109 _cell_angle_gamma 90.00020930 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5(Si5Ir2)2 _chemical_formula_sum 'Tm10 Si20 Ir8' _cell_volume 660.57824794 _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 Tm Tm0 1 0.50000010 0.49999721 -0.00000001 1.0 Tm Tm1 1 0.00000072 0.00000297 0.00000001 1.0 Tm Tm2 1 0.67449104 0.17448801 0.50000001 1.0 Tm Tm3 1 0.32550751 0.82551410 0.49999995 1.0 Tm Tm4 1 0.17449117 0.32550196 0.49999995 1.0 Tm Tm5 1 0.82551117 0.67449588 0.50000002 1.0 Tm Tm6 1 0.88494120 0.38493624 0.49999995 1.0 Tm Tm7 1 0.11506316 0.61506811 0.49999999 1.0 Tm Tm8 1 0.38492736 0.11506364 0.49999998 1.0 Tm Tm9 1 0.61506946 0.88493076 0.49999993 1.0 Si Si10 1 0.56627892 0.06627574 0.00000003 1.0 Si Si11 1 0.43371655 0.93372098 0.00000003 1.0 Si Si12 1 0.06627971 0.43371768 0.00000000 1.0 Si Si13 1 0.93371877 0.56628518 -0.00000002 1.0 Si Si14 1 0.66465521 0.70141139 0.00000005 1.0 Si Si15 1 0.33534607 0.29858801 0.00000002 1.0 Si Si16 1 0.16465430 0.79859358 -0.00000002 1.0 Si Si17 1 0.83534647 0.20140789 -0.00000005 1.0 Si Si18 1 0.29858906 0.66465567 0.00000000 1.0 Si Si19 1 0.70140909 0.33534516 0.00000003 1.0 Si Si20 1 0.20140692 0.16465208 -0.00000006 1.0 Si Si21 1 0.79859214 0.83534857 0.00000006 1.0 Si Si22 1 0.65588643 0.50301706 0.50000002 1.0 Si Si23 1 0.34411327 0.49699121 0.50000001 1.0 Si Si24 1 0.15588319 0.99698151 0.50000001 1.0 Si Si25 1 0.84411779 0.00301016 0.50000000 1.0 Si Si26 1 0.49698493 0.65588913 0.50000002 1.0 Si Si27 1 0.50301350 0.34411308 0.49999999 1.0 Si Si28 1 0.00301422 0.15587917 0.50000004 1.0 Si Si29 1 0.99699067 0.84411796 0.50000003 1.0 Ir Ir30 1 0.74487517 0.51979591 -0.00000005 1.0 Ir Ir31 1 0.25512337 0.48019747 -0.00000000 1.0 Ir Ir32 1 0.24488692 0.98020465 -0.00000002 1.0 Ir Ir33 1 0.75511069 0.01980335 0.00000008 1.0 Ir Ir34 1 0.48020169 0.74489514 -0.00000002 1.0 Ir Ir35 1 0.51979908 0.25510407 -0.00000004 1.0 Ir Ir36 1 0.01980023 0.24486581 -0.00000002 1.0 Ir Ir37 1 0.98020176 0.75513252 0.00000010 1.0