# generated using pymatgen data_GeMo6Ir3N2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.82629271 _cell_length_b 6.82086611 _cell_length_c 6.80470077 _cell_angle_alpha 89.13060743 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural GeMo6Ir3N2 _chemical_formula_sum 'Ge2 Mo12 Ir6 N4' _cell_volume 316.79875420 _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 Ge Ge0 1 0.68776281 0.17978059 0.93611054 1.0 Ge Ge1 1 0.18776281 0.82021941 0.06388946 1.0 Mo Mo2 1 0.62048452 0.04420037 0.54723682 1.0 Mo Mo3 1 0.12048452 0.95579963 0.45276318 1.0 Mo Mo4 1 0.86738568 0.53893804 0.94302790 1.0 Mo Mo5 1 0.36738568 0.46106196 0.05697210 1.0 Mo Mo6 1 0.19882319 0.62287127 0.69686715 1.0 Mo Mo7 1 0.30085703 0.12407993 0.78409762 1.0 Mo Mo8 1 0.80085703 0.87592007 0.21590238 1.0 Mo Mo9 1 0.69882319 0.37712873 0.30313285 1.0 Mo Mo10 1 0.05134337 0.21132799 0.13238282 1.0 Mo Mo11 1 0.96303030 0.30791451 0.62053750 1.0 Mo Mo12 1 0.55134337 0.78867201 0.86761718 1.0 Mo Mo13 1 0.46303030 0.69208549 0.37946250 1.0 Ir Ir14 1 0.81195372 0.68890750 0.56701077 1.0 Ir Ir15 1 0.31195372 0.31109250 0.43298923 1.0 Ir Ir16 1 0.05893308 0.56972731 0.29990750 1.0 Ir Ir17 1 0.43672038 0.06170440 0.17322660 1.0 Ir Ir18 1 0.55893308 0.43027269 0.70009250 1.0 Ir Ir19 1 0.93672038 0.93829560 0.82677340 1.0 N N20 1 0.37501553 0.87164461 0.62054719 1.0 N N21 1 0.87501553 0.12835539 0.37945281 1.0 N N22 1 0.12769339 0.37644112 0.87388416 1.0 N N23 1 0.62769339 0.62355888 0.12611584 1.0