# generated using pymatgen data_Ca4(Al8Pt3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.48513399 _cell_length_b 7.49453856 _cell_length_c 13.30442148 _cell_angle_alpha 84.65734963 _cell_angle_beta 79.22823938 _cell_angle_gamma 59.95090909 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca4(Al8Pt3)3 _chemical_formula_sum 'Ca4 Al24 Pt9' _cell_volume 634.65144814 _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 Ca Ca0 1 0.39592650 0.16769081 0.80626023 1.0 Ca Ca1 1 0.60407350 0.83230919 0.19373977 1.0 Ca Ca2 1 0.73272733 0.49975588 0.80627385 1.0 Ca Ca3 1 0.26727267 0.50024412 0.19372615 1.0 Al Al4 1 0.68585976 0.83359017 0.94890678 1.0 Al Al5 1 0.31414024 0.16640983 0.05109322 1.0 Al Al6 1 0.14768530 0.83175338 0.55915835 1.0 Al Al7 1 0.85231470 0.16824662 0.44084165 1.0 Al Al8 1 0.48014748 0.16670343 0.55835543 1.0 Al Al9 1 0.51985252 0.83329657 0.44164457 1.0 Al Al10 1 0.21529355 0.16589882 0.33267040 1.0 Al Al11 1 0.78470645 0.83410118 0.66732960 1.0 Al Al12 1 0.43747036 0.50717745 0.66687900 1.0 Al Al13 1 0.56252964 0.49282255 0.33312100 1.0 Al Al14 1 0.11081886 0.15879018 0.66557684 1.0 Al Al15 1 0.88918114 0.84120982 0.33442316 1.0 Al Al16 1 0.34836162 0.50202933 0.94913793 1.0 Al Al17 1 0.65163838 0.49797067 0.05086207 1.0 Al Al18 1 0.01415581 0.16549850 0.95683329 1.0 Al Al19 1 0.98584419 0.83450150 0.04316671 1.0 Al Al20 1 0.18661023 0.49855907 0.44163998 1.0 Al Al21 1 0.81338977 0.50144093 0.55836002 1.0 Al Al22 1 0.73428668 0.16577299 0.18374978 1.0 Al Al23 1 0.26571332 0.83422701 0.81625022 1.0 Al Al24 1 0.06156786 0.63047767 0.81514195 1.0 Al Al25 1 0.93843214 0.36952233 0.18485805 1.0 Al Al26 1 0.85616646 0.03963596 0.81608948 1.0 Al Al27 1 0.14383354 0.96036404 0.18391052 1.0 Pt Pt28 1 0.12129462 0.49272262 0.63660474 1.0 Pt Pt29 1 0.87870538 0.50727738 0.36339526 1.0 Pt Pt30 1 0.65740855 0.17116765 0.00013879 1.0 Pt Pt31 1 0.34259145 0.82883235 0.99986121 1.0 Pt Pt32 1 0.53916381 0.16648812 0.36334527 1.0 Pt Pt33 1 0.46083619 0.83351188 0.63665473 1.0 Pt Pt34 1 0.78127023 0.17364349 0.63598728 1.0 Pt Pt35 1 0.21872977 0.82635651 0.36401272 1.0 Pt Pt36 1 0.00000000 0.50000000 0.00000000 1.0