# generated using pymatgen data_Er2Mn6P7Ir6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.47681878 _cell_length_b 9.47681935 _cell_length_c 3.88946944 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000257 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er2Mn6P7Ir6 _chemical_formula_sum 'Er2 Mn6 P7 Ir6' _cell_volume 302.51447660 _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 Er Er0 1 0.33333300 0.66666700 0.00000000 1.0 Er Er1 1 0.00000000 0.00000000 0.50000000 1.0 Mn Mn2 1 0.55289704 0.05648006 0.00000000 1.0 Mn Mn3 1 0.94351994 0.49641798 0.00000000 1.0 Mn Mn4 1 0.50358202 0.44710296 0.00000000 1.0 Mn Mn5 1 0.79202509 0.23113919 0.50000000 1.0 Mn Mn6 1 0.76886081 0.56088590 0.50000000 1.0 Mn Mn7 1 0.43911410 0.20797491 0.50000000 1.0 P P8 1 0.78048945 0.02932784 0.00000000 1.0 P P9 1 0.97067216 0.75116061 0.00000000 1.0 P P10 1 0.24883939 0.21951055 0.00000000 1.0 P P11 1 0.37866057 0.92199532 0.50000000 1.0 P P12 1 0.07800468 0.45666626 0.50000000 1.0 P P13 1 0.54333374 0.62133943 0.50000000 1.0 P P14 1 0.66666700 0.33333300 0.00000000 1.0 Ir Ir15 1 0.02742923 0.26708132 0.00000000 1.0 Ir Ir16 1 0.73291868 0.76034691 0.00000000 1.0 Ir Ir17 1 0.23965309 0.97257077 0.00000000 1.0 Ir Ir18 1 0.60854163 0.89232951 0.50000000 1.0 Ir Ir19 1 0.10767049 0.71621112 0.50000000 1.0 Ir Ir20 1 0.28378888 0.39145837 0.50000000 1.0