# generated using pymatgen data_Ca3Sm(OsC2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.19230638 _cell_length_b 6.47891030 _cell_length_c 10.37505439 _cell_angle_alpha 90.22483701 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3Sm(OsC2)2 _chemical_formula_sum 'Ca6 Sm2 Os4 C8' _cell_volume 349.01919792 _cell_formula_units_Z 2 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 0.75000000 0.80661297 0.05237901 1.0 Ca Ca1 1 0.25000000 0.19338703 0.94762099 1.0 Ca Ca2 1 0.25000000 0.53566846 0.21514992 1.0 Ca Ca3 1 0.75000000 0.46433154 0.78485008 1.0 Ca Ca4 1 0.75000000 0.96705346 0.72923735 1.0 Ca Ca5 1 0.25000000 0.03294654 0.27076265 1.0 Sm Sm6 1 0.25000000 0.69284349 0.55288747 1.0 Sm Sm7 1 0.75000000 0.30715651 0.44711253 1.0 Os Os8 1 0.25000000 0.73088781 0.85277143 1.0 Os Os9 1 0.75000000 0.26911219 0.14722857 1.0 Os Os10 1 0.75000000 0.77023867 0.35160671 1.0 Os Os11 1 0.25000000 0.22976133 0.64839329 1.0 C C12 1 0.25000000 0.47039640 0.75543923 1.0 C C13 1 0.75000000 0.52960360 0.24456077 1.0 C C14 1 0.75000000 0.03395142 0.26065830 1.0 C C15 1 0.25000000 0.96604858 0.73934170 1.0 C C16 1 0.25000000 0.79295418 0.02569735 1.0 C C17 1 0.75000000 0.20704582 0.97430265 1.0 C C18 1 0.75000000 0.69852344 0.52657340 1.0 C C19 1 0.25000000 0.30147656 0.47342660 1.0