# generated using pymatgen data_Zr20Co4(As3P)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.69463916 _cell_length_b 10.43685472 _cell_length_c 17.50651629 _cell_angle_alpha 89.98423785 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr20Co4(As3P)3 _chemical_formula_sum 'Zr20 Co4 As9 P3' _cell_volume 675.05845844 _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 Zr Zr0 1 0.25000000 0.12669108 0.47790485 1.0 Zr Zr1 1 0.75000000 0.87801150 0.52254534 1.0 Zr Zr2 1 0.75000000 0.62779492 0.02192222 1.0 Zr Zr3 1 0.25000000 0.37294025 0.97771927 1.0 Zr Zr4 1 0.25000000 0.05947157 0.07372419 1.0 Zr Zr5 1 0.75000000 0.94111901 0.92690769 1.0 Zr Zr6 1 0.75000000 0.55409773 0.42295312 1.0 Zr Zr7 1 0.25000000 0.43752286 0.57453974 1.0 Zr Zr8 1 0.25000000 0.48540832 0.27241358 1.0 Zr Zr9 1 0.75000000 0.51373819 0.72591853 1.0 Zr Zr10 1 0.75000000 0.98637277 0.22539251 1.0 Zr Zr11 1 0.25000000 0.01528996 0.77516260 1.0 Zr Zr12 1 0.25000000 0.81408457 0.36840585 1.0 Zr Zr13 1 0.75000000 0.18761755 0.62912150 1.0 Zr Zr14 1 0.75000000 0.31222933 0.12813884 1.0 Zr Zr15 1 0.25000000 0.68789996 0.87143641 1.0 Zr Zr16 1 0.25000000 0.75952909 0.16439343 1.0 Zr Zr17 1 0.75000000 0.24072445 0.83555883 1.0 Zr Zr18 1 0.75000000 0.25943071 0.33434206 1.0 Zr Zr19 1 0.25000000 0.74182324 0.66722259 1.0 Co Co20 1 0.25000000 0.36351214 0.41354200 1.0 Co Co21 1 0.75000000 0.63203756 0.59250548 1.0 Co Co22 1 0.75000000 0.86561762 0.08630374 1.0 Co Co23 1 0.25000000 0.13474628 0.91346489 1.0 As As24 1 0.25000000 0.68535064 0.50865535 1.0 As As25 1 0.25000000 0.50728008 0.11585040 1.0 As As26 1 0.75000000 0.49298536 0.88361207 1.0 As As27 1 0.75000000 0.00794172 0.38261155 1.0 As As28 1 0.25000000 0.99326465 0.61775412 1.0 As As29 1 0.25000000 0.18847024 0.21858290 1.0 As As30 1 0.75000000 0.81405385 0.78232387 1.0 As As31 1 0.75000000 0.68712901 0.27975235 1.0 As As32 1 0.25000000 0.31116115 0.71980335 1.0 P P33 1 0.25000000 0.81526346 0.01033925 1.0 P P34 1 0.75000000 0.18524822 0.98964145 1.0 P P35 1 0.75000000 0.31414097 0.48953708 1.0