# generated using pymatgen data_ThGaSiTc4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.22903413 _cell_length_b 7.19315813 _cell_length_c 15.63882153 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ThGaSiTc4 _chemical_formula_sum 'Th4 Ga4 Si4 Tc16' _cell_volume 475.73469070 _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 Th Th0 1 0.00000000 0.59465902 0.11831770 1.0 Th Th1 1 0.00000000 0.40534098 0.88168230 1.0 Th Th2 1 0.50000000 0.09465902 0.38168230 1.0 Th Th3 1 0.50000000 0.90534098 0.61831770 1.0 Ga Ga4 1 0.00000000 0.82975769 0.47245854 1.0 Ga Ga5 1 0.00000000 0.17024231 0.52754146 1.0 Ga Ga6 1 0.50000000 0.32975769 0.02754146 1.0 Ga Ga7 1 0.50000000 0.67024231 0.97245854 1.0 Si Si8 1 0.00000000 0.31125085 0.27356052 1.0 Si Si9 1 0.00000000 0.68874915 0.72643948 1.0 Si Si10 1 0.50000000 0.81125085 0.22643948 1.0 Si Si11 1 0.50000000 0.18874915 0.77356052 1.0 Tc Tc12 1 0.00000000 0.13131246 0.05460782 1.0 Tc Tc13 1 0.00000000 0.86868754 0.94539218 1.0 Tc Tc14 1 0.50000000 0.63131246 0.44539218 1.0 Tc Tc15 1 0.50000000 0.36868754 0.55460782 1.0 Tc Tc16 1 0.00000000 0.72931114 0.31483719 1.0 Tc Tc17 1 0.00000000 0.27068886 0.68516281 1.0 Tc Tc18 1 0.50000000 0.22931114 0.18516281 1.0 Tc Tc19 1 0.50000000 0.77068886 0.81483719 1.0 Tc Tc20 1 0.00000000 0.44453897 0.41968404 1.0 Tc Tc21 1 0.00000000 0.55546103 0.58031596 1.0 Tc Tc22 1 0.50000000 0.94453897 0.08031596 1.0 Tc Tc23 1 0.50000000 0.05546103 0.91968404 1.0 Tc Tc24 1 0.00000000 0.00205628 0.20795657 1.0 Tc Tc25 1 0.00000000 0.99794372 0.79204343 1.0 Tc Tc26 1 0.50000000 0.50205628 0.29204343 1.0 Tc Tc27 1 0.50000000 0.49794372 0.70795657 1.0