# generated using pymatgen data_Li2TcNiAs2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.87467926 _cell_length_b 3.87467926 _cell_length_c 6.21419635 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2TcNiAs2 _chemical_formula_sum 'Li2 Tc1 Ni1 As2' _cell_volume 93.29459610 _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 Li Li0 1 0.00000000 0.50000000 0.33891096 1.0 Li Li1 1 0.50000000 0.00000000 0.66108904 1.0 Tc Tc2 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni3 1 0.50000000 0.50000000 0.00000000 1.0 As As4 1 0.00000000 0.50000000 0.76767066 1.0 As As5 1 0.50000000 0.00000000 0.23232934 1.0