# generated using pymatgen data_Li2Tc3P7Ir9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.36510127 _cell_length_b 9.36510086 _cell_length_c 3.92105292 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000237 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Tc3P7Ir9 _chemical_formula_sum 'Li2 Tc3 P7 Ir9' _cell_volume 297.82301948 _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 0.33333300 0.66666700 0.73653679 1.0 Li Li1 1 0.66666700 0.33333300 0.24324137 1.0 Tc Tc2 1 0.21216362 0.07985124 0.23778792 1.0 Tc Tc3 1 0.86768761 0.78783638 0.23778792 1.0 Tc Tc4 1 0.92014876 0.13231239 0.23778792 1.0 P P5 1 0.00000000 0.00000000 0.73743843 1.0 P P6 1 0.28227867 0.87263210 0.23788151 1.0 P P7 1 0.59035243 0.71772133 0.23788151 1.0 P P8 1 0.12736790 0.40964757 0.23788151 1.0 P P9 1 0.69750068 0.12523452 0.73847995 1.0 P P10 1 0.42773383 0.30249932 0.73847995 1.0 P P11 1 0.87476548 0.57226617 0.73847995 1.0 Ir Ir12 1 0.72740408 0.89558433 0.73778116 1.0 Ir Ir13 1 0.16818025 0.27259592 0.73778116 1.0 Ir Ir14 1 0.10441567 0.83181975 0.73778116 1.0 Ir Ir15 1 0.05223847 0.60598299 0.23786589 1.0 Ir Ir16 1 0.55374452 0.94776153 0.23786589 1.0 Ir Ir17 1 0.39401701 0.44625548 0.23786589 1.0 Ir Ir18 1 0.93116040 0.36437645 0.73779804 1.0 Ir Ir19 1 0.43321605 0.06883960 0.73779804 1.0 Ir Ir20 1 0.63562355 0.56678395 0.73779804 1.0