# generated using pymatgen data_GaTc20(B3Mo)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.04109386 _cell_length_b 8.04109406 _cell_length_c 8.04109330 _cell_angle_alpha 60.00000314 _cell_angle_beta 60.00000232 _cell_angle_gamma 60.00000004 _symmetry_Int_Tables_number 1 _chemical_formula_structural GaTc20(B3Mo)2 _chemical_formula_sum 'Ga1 Tc20 B6 Mo2' _cell_volume 367.64646585 _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 Ga Ga0 1 0.00000000 0.00000000 0.00000000 1.0 Tc Tc1 1 0.61982818 0.61982818 0.14051546 1.0 Tc Tc2 1 0.61982818 0.14051546 0.61982818 1.0 Tc Tc3 1 0.14051546 0.61982818 0.61982818 1.0 Tc Tc4 1 0.61982818 0.61982818 0.61982818 1.0 Tc Tc5 1 0.38017182 0.38017182 0.85948454 1.0 Tc Tc6 1 0.38017182 0.85948454 0.38017182 1.0 Tc Tc7 1 0.85948454 0.38017182 0.38017182 1.0 Tc Tc8 1 0.38017182 0.38017182 0.38017182 1.0 Tc Tc9 1 0.00000000 0.00000000 0.34009384 1.0 Tc Tc10 1 0.65990616 1.00000000 0.34009384 1.0 Tc Tc11 1 1.00000000 0.65990616 0.34009384 1.0 Tc Tc12 1 0.65990616 0.34009384 1.00000000 1.0 Tc Tc13 1 0.00000000 0.34009384 1.00000000 1.0 Tc Tc14 1 0.00000000 0.34009384 0.65990616 1.0 Tc Tc15 1 0.34009384 0.65990616 0.00000000 1.0 Tc Tc16 1 0.34009384 0.00000000 0.65990616 1.0 Tc Tc17 1 0.34009384 0.00000000 1.00000000 1.0 Tc Tc18 1 0.00000000 0.00000000 0.65990616 1.0 Tc Tc19 1 1.00000000 0.65990616 0.00000000 1.0 Tc Tc20 1 0.65990616 1.00000000 0.00000000 1.0 B B21 1 0.71953639 0.71953639 0.28046361 1.0 B B22 1 0.28046361 0.71953639 0.28046361 1.0 B B23 1 0.71953639 0.28046361 0.28046361 1.0 B B24 1 0.28046361 0.28046361 0.71953639 1.0 B B25 1 0.71953639 0.28046361 0.71953639 1.0 B B26 1 0.28046361 0.71953639 0.71953639 1.0 Mo Mo27 1 0.75000000 0.75000000 0.75000000 1.0 Mo Mo28 1 0.25000000 0.25000000 0.25000000 1.0