# generated using pymatgen data_Cr2N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.75137275 _cell_length_b 4.75136667 _cell_length_c 4.37583802 _cell_angle_alpha 90.00049796 _cell_angle_beta 89.99976068 _cell_angle_gamma 120.00007748 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr2N _chemical_formula_sum 'Cr6 N3' _cell_volume 85.55180559 _cell_formula_units_Z 3 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 Cr Cr0 1 0.00000048 0.67398878 0.74719564 1.0 Cr Cr1 1 0.67399250 0.00000161 0.74719827 1.0 Cr Cr2 1 0.32600679 0.32600853 0.74719856 1.0 Cr Cr3 1 0.67399271 0.67399217 0.25280197 1.0 Cr Cr4 1 0.00000036 0.32600911 0.25280220 1.0 Cr Cr5 1 0.32600700 -0.00000013 0.25280342 1.0 N N6 1 -0.00000004 0.00000038 0.00000229 1.0 N N7 1 0.66666971 0.33333518 0.50000037 1.0 N N8 1 0.33333050 0.66666637 0.50000029 1.0