# generated using pymatgen data_TcRu2SeF24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.87992523 _cell_length_b 8.41828039 _cell_length_c 9.18184560 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.35114450 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TcRu2SeF24 _chemical_formula_sum 'Tc1 Ru2 Se1 F24' _cell_volume 377.18844838 _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 Tc Tc0 1 0.58697792 0.75000000 0.12892383 1.0 Ru Ru1 1 0.08495637 0.25000000 0.37186425 1.0 Ru Ru2 1 0.41374114 0.25000000 0.87078736 1.0 Se Se3 1 0.91459706 0.75000000 0.62813521 1.0 F F4 1 0.19271124 0.75000000 0.51569950 1.0 F F5 1 0.78076506 0.25000000 0.48770026 1.0 F F6 1 0.71916234 0.25000000 0.98838393 1.0 F F7 1 0.28141238 0.75000000 0.01403044 1.0 F F8 1 0.63574608 0.75000000 0.74068023 1.0 F F9 1 0.38852618 0.25000000 0.25436187 1.0 F F10 1 0.10585880 0.25000000 0.75507275 1.0 F F11 1 0.89456097 0.75000000 0.24245637 1.0 F F12 1 0.76273399 0.60688250 0.52295011 1.0 F F13 1 0.24383932 0.40332502 0.48721413 1.0 F F14 1 0.26003581 0.40463470 0.98737115 1.0 F F15 1 0.24383932 0.09667498 0.48721413 1.0 F F16 1 0.73598960 0.59683184 0.01671280 1.0 F F17 1 0.76273399 0.89311750 0.52295011 1.0 F F18 1 0.73598960 0.90316816 0.01671280 1.0 F F19 1 0.26003581 0.09536530 0.98737115 1.0 F F20 1 0.06439634 0.60680784 0.73363106 1.0 F F21 1 0.92782041 0.40447522 0.25583560 1.0 F F22 1 0.56748008 0.40357403 0.75532007 1.0 F F23 1 0.92782041 0.09552478 0.25583560 1.0 F F24 1 0.43819618 0.59741724 0.24192059 1.0 F F25 1 0.06439634 0.89319216 0.73363106 1.0 F F26 1 0.43819618 0.90258276 0.24192059 1.0 F F27 1 0.56748008 0.09642597 0.75532007 1.0