# generated using pymatgen data_TaAs2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.41990513 _cell_length_b 4.98527149 _cell_length_c 7.02980015 _cell_angle_alpha 78.95985870 _cell_angle_beta 75.91508262 _cell_angle_gamma 69.97065394 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaAs2 _chemical_formula_sum 'Ta2 As4' _cell_volume 108.44605450 _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 Ta Ta0 1 0.15733470 0.88133865 0.80383671 1.0 Ta Ta1 1 0.84266530 0.11866135 0.19616329 1.0 As As2 1 0.85963079 0.75182409 0.52783753 1.0 As As3 1 0.14036921 0.24817591 0.47216247 1.0 As As4 1 0.40614563 0.29476358 0.89408287 1.0 As As5 1 0.59385437 0.70523642 0.10591713 1.0