# generated using pymatgen data_K3Rb(MoN2)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.05476159 _cell_length_b 8.07812687 _cell_length_c 12.15254520 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural K3Rb(MoN2)4 _chemical_formula_sum 'K6 Rb2 Mo8 N16' _cell_volume 594.39474577 _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 K K0 1 0.75000000 0.14172284 0.00000000 1.0 K K1 1 0.25000000 0.85827716 0.50000000 1.0 K K2 1 0.59638625 0.38557353 0.25044164 1.0 K K3 1 0.09638625 0.61442647 0.24955836 1.0 K K4 1 0.40361375 0.61442647 0.75044164 1.0 K K5 1 0.90361375 0.38557353 0.74955836 1.0 Rb Rb6 1 0.25000000 0.86303344 0.00000000 1.0 Rb Rb7 1 0.75000000 0.13696656 0.50000000 1.0 Mo Mo8 1 0.25000000 0.36178463 0.00000000 1.0 Mo Mo9 1 0.75000000 0.63821537 0.50000000 1.0 Mo Mo10 1 0.75000000 0.63161490 0.00000000 1.0 Mo Mo11 1 0.25000000 0.36838510 0.50000000 1.0 Mo Mo12 1 0.15625840 0.10851894 0.25012162 1.0 Mo Mo13 1 0.65625840 0.89148106 0.24987838 1.0 Mo Mo14 1 0.84374160 0.89148106 0.75012162 1.0 Mo Mo15 1 0.34374160 0.10851894 0.74987838 1.0 N N16 1 0.84021052 0.08154721 0.24405595 1.0 N N17 1 0.34021052 0.91845279 0.25594405 1.0 N N18 1 0.15978948 0.91845279 0.74405595 1.0 N N19 1 0.65978948 0.08154721 0.75594405 1.0 N N20 1 0.22803400 0.23423413 0.37420012 1.0 N N21 1 0.72803400 0.76576587 0.12579988 1.0 N N22 1 0.77196600 0.76576587 0.87420012 1.0 N N23 1 0.27196600 0.23423413 0.62579988 1.0 N N24 1 0.75406764 0.77323214 0.62603481 1.0 N N25 1 0.25406764 0.22676786 0.87396519 1.0 N N26 1 0.24593236 0.22676786 0.12603481 1.0 N N27 1 0.74593236 0.77323214 0.37396519 1.0 N N28 1 0.50013760 0.50356177 0.49509058 1.0 N N29 1 0.00013760 0.49643823 0.00490942 1.0 N N30 1 0.49986240 0.49643823 0.99509058 1.0 N N31 1 0.99986240 0.50356177 0.50490942 1.0