# generated using pymatgen data_AlCrN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.39825998 _cell_length_b 4.49810238 _cell_length_c 8.72347379 _cell_angle_alpha 90.00000192 _cell_angle_beta 143.89995920 _cell_angle_gamma 114.62170295 _symmetry_Int_Tables_number 1 _chemical_formula_structural AlCrN2 _chemical_formula_sum 'Al2 Cr2 N4' _cell_volume 88.25067180 _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 Al Al0 1 0.00000000 0.50000000 0.25000000 1.0 Al Al1 1 0.00000000 0.00000000 0.00000000 1.0 Cr Cr2 1 0.00000000 0.50000000 0.75000000 1.0 Cr Cr3 1 0.00000000 0.00000000 0.50000000 1.0 N N4 1 0.50000000 0.01204000 0.12500000 1.0 N N5 1 0.50000000 0.98796000 0.62500000 1.0 N N6 1 0.47591900 0.48796000 0.36296000 1.0 N N7 1 0.52408100 0.51204000 0.88704000 1.0