# generated using pymatgen data_Pa5Ti(AlPt)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.93463880 _cell_length_b 6.93456333 _cell_length_c 8.27536566 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.58879505 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pa5Ti(AlPt)6 _chemical_formula_sum 'Pa5 Ti1 Al6 Pt6' _cell_volume 346.05525410 _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 Pa Pa0 1 0.57649152 0.99810876 0.75000000 1.0 Pa Pa1 1 0.99811423 0.57650539 0.75000000 1.0 Pa Pa2 1 0.99486373 0.57987018 0.25000000 1.0 Pa Pa3 1 0.57985234 0.99484758 0.25000000 1.0 Pa Pa4 1 0.43473400 0.43473645 0.25000000 1.0 Ti Ti5 1 0.39907307 0.39908866 0.75000000 1.0 Al Al6 1 0.75896171 0.75895706 0.98963951 1.0 Al Al7 1 0.24041255 0.00441053 0.99858201 1.0 Al Al8 1 0.00439685 0.24040733 0.99857628 1.0 Al Al9 1 0.75896171 0.75895706 0.51036049 1.0 Al Al10 1 0.24041255 0.00441053 0.50141799 1.0 Al Al11 1 0.00439685 0.24040733 0.50142372 1.0 Pt Pt12 1 0.01167328 0.01167579 0.75000000 1.0 Pt Pt13 1 0.00970337 0.00971197 0.25000000 1.0 Pt Pt14 1 0.66097939 0.33299193 0.99097934 1.0 Pt Pt15 1 0.66097939 0.33299193 0.50902066 1.0 Pt Pt16 1 0.33299522 0.66096076 0.50902891 1.0 Pt Pt17 1 0.33299522 0.66096076 0.99097209 1.0