# generated using pymatgen data_TmAs3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.93631200 _cell_length_b 5.93631200 _cell_length_c 5.49120400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000003 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmAs3 _chemical_formula_sum 'Tm2 As6' _cell_volume 167.58365073 _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 0.33333300 0.66666700 0.75000000 1.0 Tm Tm1 1 0.66666700 0.33333300 0.25000000 1.0 As As2 1 0.18166400 0.36332800 0.25000000 1.0 As As3 1 0.63667200 0.81833600 0.25000000 1.0 As As4 1 0.18166400 0.81833600 0.25000000 1.0 As As5 1 0.81833600 0.63667200 0.75000000 1.0 As As6 1 0.36332800 0.18166400 0.75000000 1.0 As As7 1 0.81833600 0.18166400 0.75000000 1.0