# generated using pymatgen data_Cr12As4C3N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.30342079 _cell_length_b 5.30342079 _cell_length_c 14.85915796 _cell_angle_alpha 89.75406617 _cell_angle_beta 89.75406617 _cell_angle_gamma 33.08771919 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr12As4C3N _chemical_formula_sum 'Cr12 As4 C3 N1' _cell_volume 228.15654262 _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 Cr Cr0 1 0.87716700 0.87716700 0.22526900 1.0 Cr Cr1 1 0.87701800 0.87701800 0.72455900 1.0 Cr Cr2 1 0.12298200 0.12298200 0.27544100 1.0 Cr Cr3 1 0.12283300 0.12283300 0.77473100 1.0 Cr Cr4 1 0.87720400 0.87720400 0.02545800 1.0 Cr Cr5 1 0.87889500 0.87889500 0.52411900 1.0 Cr Cr6 1 0.12110500 0.12110500 0.47588100 1.0 Cr Cr7 1 0.12279600 0.12279600 0.97454200 1.0 Cr Cr8 1 0.54010200 0.54010200 0.12525700 1.0 Cr Cr9 1 0.53981900 0.53981900 0.62348700 1.0 Cr Cr10 1 0.46018100 0.46018100 0.37651300 1.0 Cr Cr11 1 0.45989800 0.45989800 0.87474300 1.0 As As12 1 0.23967600 0.23967600 0.12510200 1.0 As As13 1 0.24054200 0.24054200 0.62477200 1.0 As As14 1 0.75945800 0.75945800 0.37522800 1.0 As As15 1 0.76032400 0.76032400 0.87489800 1.0 C C16 1 0.49990500 0.49990500 0.25050800 1.0 C C17 1 0.50009500 0.50009500 0.74949200 1.0 C C18 1 0.50000000 0.50000000 0.00000000 1.0 N N19 1 0.50000000 0.50000000 0.50000000 1.0