# generated using pymatgen data_Zr5Co19(As3P)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.05339714 _cell_length_b 12.05339695 _cell_length_c 3.70006897 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999521 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5Co19(As3P)3 _chemical_formula_sum 'Zr5 Co19 As9 P3' _cell_volume 465.54256690 _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 0.33333300 0.66666700 0.50000000 1.0 Zr Zr1 1 0.66666700 0.33333300 0.50000000 1.0 Zr Zr2 1 0.17719364 1.00000000 0.00000000 1.0 Zr Zr3 1 1.00000000 0.17719364 0.00000000 1.0 Zr Zr4 1 0.82280636 0.82280636 0.00000000 1.0 Co Co5 1 0.19761249 0.36952687 0.50000000 1.0 Co Co6 1 0.63047313 0.82808562 0.50000000 1.0 Co Co7 1 0.17191438 0.80238751 0.50000000 1.0 Co Co8 1 0.82808562 0.63047313 0.50000000 1.0 Co Co9 1 0.80238751 0.17191438 0.50000000 1.0 Co Co10 1 0.36952687 0.19761249 0.50000000 1.0 Co Co11 1 0.55549847 1.00000000 0.50000000 1.0 Co Co12 1 1.00000000 0.55549847 0.50000000 1.0 Co Co13 1 0.44450153 0.44450153 0.50000000 1.0 Co Co14 1 0.12470435 0.47926922 0.00000000 1.0 Co Co15 1 0.52073078 0.64543513 0.00000000 1.0 Co Co16 1 0.35456487 0.87529565 0.00000000 1.0 Co Co17 1 0.64543513 0.52073078 0.00000000 1.0 Co Co18 1 0.87529565 0.35456487 0.00000000 1.0 Co Co19 1 0.47926922 0.12470435 0.00000000 1.0 Co Co20 1 0.72679016 0.00000000 0.00000000 1.0 Co Co21 1 0.00000000 0.72679016 0.00000000 1.0 Co Co22 1 0.27320984 0.27320984 0.00000000 1.0 Co Co23 1 0.00000000 0.00000000 0.50000000 1.0 As As24 1 0.35818208 0.00000000 0.50000000 1.0 As As25 1 0.00000000 0.35818208 0.50000000 1.0 As As26 1 0.64181792 0.64181792 0.50000000 1.0 As As27 1 0.31723699 0.48139255 0.00000000 1.0 As As28 1 0.51860745 0.83584444 0.00000000 1.0 As As29 1 0.16415556 0.68276301 0.00000000 1.0 As As30 1 0.83584444 0.51860745 0.00000000 1.0 As As31 1 0.68276301 0.16415556 0.00000000 1.0 As As32 1 0.48139255 0.31723699 0.00000000 1.0 P P33 1 0.82486758 0.00000000 0.50000000 1.0 P P34 1 0.00000000 0.82486758 0.50000000 1.0 P P35 1 0.17513242 0.17513242 0.50000000 1.0