# generated using pymatgen data_LiCo4TcP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.58315819 _cell_length_b 10.03191801 _cell_length_c 11.56882327 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiCo4TcP3 _chemical_formula_sum 'Li4 Co16 Tc4 P12' _cell_volume 415.85233338 _cell_formula_units_Z 4 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 0.25000000 0.58004385 0.70299349 1.0 Li Li1 1 0.25000000 0.91995615 0.20299349 1.0 Li Li2 1 0.75000000 0.41995615 0.29700651 1.0 Li Li3 1 0.75000000 0.08004385 0.79700651 1.0 Co Co4 1 0.25000000 0.40853704 0.48844246 1.0 Co Co5 1 0.25000000 0.09146296 0.98844246 1.0 Co Co6 1 0.75000000 0.59146296 0.51155754 1.0 Co Co7 1 0.75000000 0.90853704 0.01155754 1.0 Co Co8 1 0.25000000 0.21930692 0.17812962 1.0 Co Co9 1 0.25000000 0.28069308 0.67812962 1.0 Co Co10 1 0.75000000 0.78069308 0.82187038 1.0 Co Co11 1 0.75000000 0.71930692 0.32187038 1.0 Co Co12 1 0.25000000 0.88258196 0.70017971 1.0 Co Co13 1 0.25000000 0.61741804 0.20017971 1.0 Co Co14 1 0.75000000 0.11741804 0.29982029 1.0 Co Co15 1 0.75000000 0.38258196 0.79982029 1.0 Co Co16 1 0.25000000 0.46438276 0.93347278 1.0 Co Co17 1 0.25000000 0.03561724 0.43347278 1.0 Co Co18 1 0.75000000 0.53561724 0.06652722 1.0 Co Co19 1 0.75000000 0.96438276 0.56652722 1.0 Tc Tc20 1 0.25000000 0.71018044 0.98651242 1.0 Tc Tc21 1 0.25000000 0.78981956 0.48651242 1.0 Tc Tc22 1 0.75000000 0.28981956 0.01348758 1.0 Tc Tc23 1 0.75000000 0.21018044 0.51348758 1.0 P P24 1 0.25000000 0.42027609 0.12091369 1.0 P P25 1 0.25000000 0.07972391 0.62091369 1.0 P P26 1 0.75000000 0.57972391 0.87908631 1.0 P P27 1 0.75000000 0.92027609 0.37908631 1.0 P P28 1 0.25000000 0.26012919 0.86462130 1.0 P P29 1 0.25000000 0.23987081 0.36462130 1.0 P P30 1 0.75000000 0.73987081 0.13537870 1.0 P P31 1 0.75000000 0.76012919 0.63537870 1.0 P P32 1 0.25000000 0.59147710 0.38735967 1.0 P P33 1 0.25000000 0.90852290 0.88735967 1.0 P P34 1 0.75000000 0.40852290 0.61264033 1.0 P P35 1 0.75000000 0.09147710 0.11264033 1.0