# generated using pymatgen data_Zr6SnPbC2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.28482225 _cell_length_b 6.28482231 _cell_length_c 9.19998120 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 147.98685937 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6SnPbC2 _chemical_formula_sum 'Zr6 Sn1 Pb1 C2' _cell_volume 192.63802166 _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 0.62102323 0.37897777 0.03959738 1.0 Zr Zr1 1 0.96214751 0.03785449 0.25000000 1.0 Zr Zr2 1 0.62102323 0.37897777 0.46040262 1.0 Zr Zr3 1 0.37797952 0.62202148 0.54410346 1.0 Zr Zr4 1 0.04064167 0.95936033 0.75000000 1.0 Zr Zr5 1 0.37797952 0.62202148 0.95589654 1.0 Sn Sn6 1 0.74672588 0.25327512 0.75000000 1.0 Pb Pb7 1 0.25356089 0.74644011 0.25000000 1.0 C C8 1 0.99946276 0.00053724 0.99976706 1.0 C C9 1 0.99946276 0.00053724 0.50023294 1.0