# generated using pymatgen data_Ca3(GaPt)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.78253037 _cell_length_b 7.85123500 _cell_length_c 13.80800037 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3(GaPt)2 _chemical_formula_sum 'Ca12 Ga8 Pt8' _cell_volume 626.88328348 _cell_formula_units_Z 4 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 0.14298483 0.60640494 0.09828158 1.0 Ca Ca1 1 0.14298483 0.89359506 0.90171842 1.0 Ca Ca2 1 0.85701517 0.10640494 0.40171842 1.0 Ca Ca3 1 0.85701517 0.39359506 0.59828158 1.0 Ca Ca4 1 0.85701517 0.39359506 0.90171842 1.0 Ca Ca5 1 0.85701517 0.10640494 0.09828158 1.0 Ca Ca6 1 0.14298483 0.89359506 0.59828158 1.0 Ca Ca7 1 0.14298483 0.60640494 0.40171842 1.0 Ca Ca8 1 0.37057023 0.25682301 0.25000000 1.0 Ca Ca9 1 0.37057023 0.24317699 0.75000000 1.0 Ca Ca10 1 0.62942977 0.75682301 0.25000000 1.0 Ca Ca11 1 0.62942977 0.74317699 0.75000000 1.0 Ga Ga12 1 0.37988067 0.25000000 -0.00000000 1.0 Ga Ga13 1 0.62011933 0.75000000 0.50000000 1.0 Ga Ga14 1 0.62011933 0.75000000 -0.00000000 1.0 Ga Ga15 1 0.37988067 0.25000000 0.50000000 1.0 Ga Ga16 1 0.85626313 0.40921560 0.25000000 1.0 Ga Ga17 1 0.85626313 0.09078440 0.75000000 1.0 Ga Ga18 1 0.14373687 0.90921560 0.25000000 1.0 Ga Ga19 1 0.14373687 0.59078440 0.75000000 1.0 Pt Pt20 1 0.63838990 0.46900601 0.09360828 1.0 Pt Pt21 1 0.63838990 0.03099399 0.90639172 1.0 Pt Pt22 1 0.36161010 0.96900601 0.40639172 1.0 Pt Pt23 1 0.36161010 0.53099399 0.59360828 1.0 Pt Pt24 1 0.36161010 0.53099399 0.90639172 1.0 Pt Pt25 1 0.36161010 0.96900601 0.09360828 1.0 Pt Pt26 1 0.63838990 0.03099399 0.59360828 1.0 Pt Pt27 1 0.63838990 0.46900601 0.40639172 1.0