# generated using pymatgen data_Ti2Co2SiP _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.59628457 _cell_length_b 6.05643157 _cell_length_c 6.82294645 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2Co2SiP _chemical_formula_sum 'Ti4 Co4 Si2 P2' _cell_volume 148.60821809 _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 Ti Ti0 1 0.25000000 0.98217806 0.31560684 1.0 Ti Ti1 1 0.25000000 0.48217806 0.18439316 1.0 Ti Ti2 1 0.75000000 0.02291350 0.67941654 1.0 Ti Ti3 1 0.75000000 0.52291350 0.82058346 1.0 Co Co4 1 0.25000000 0.85510653 0.94305178 1.0 Co Co5 1 0.25000000 0.35510653 0.55694822 1.0 Co Co6 1 0.75000000 0.13964083 0.06756970 1.0 Co Co7 1 0.75000000 0.63964083 0.43243030 1.0 Si Si8 1 0.25000000 0.22817787 0.88166439 1.0 Si Si9 1 0.25000000 0.72817787 0.61833561 1.0 P P10 1 0.75000000 0.77198321 0.11895170 1.0 P P11 1 0.75000000 0.27198321 0.38104830 1.0