# generated using pymatgen data_Sm2Mn3Cu9P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.75209200 _cell_length_b 9.31447000 _cell_length_c 9.37665906 _cell_angle_alpha 60.86773566 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2Mn3Cu9P7 _chemical_formula_sum 'Sm2 Mn3 Cu9 P7' _cell_volume 286.24754879 _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 Sm Sm0 1 0.00000000 0.66481000 0.66648700 1.0 Sm Sm1 1 0.50000000 0.33588400 0.32898100 1.0 Mn Mn2 1 0.50000000 0.78621300 0.12930500 1.0 Mn Mn3 1 0.50000000 0.12153000 0.08645600 1.0 Mn Mn4 1 0.50000000 0.08654700 0.79182900 1.0 Cu Cu5 1 0.00000000 0.57053400 0.37994900 1.0 Cu Cu6 1 0.00000000 0.38192500 0.04796500 1.0 Cu Cu7 1 0.00000000 0.04895400 0.56827600 1.0 Cu Cu8 1 0.00000000 0.84076300 0.88270600 1.0 Cu Cu9 1 0.00000000 0.87924900 0.28192900 1.0 Cu Cu10 1 0.00000000 0.27486800 0.84154300 1.0 Cu Cu11 1 0.50000000 0.61485000 0.95840600 1.0 Cu Cu12 1 0.50000000 0.95948200 0.42637100 1.0 Cu Cu13 1 0.50000000 0.42938900 0.61348700 1.0 P P14 1 0.00000000 0.60011500 0.12396800 1.0 P P15 1 0.00000000 0.12720200 0.27431300 1.0 P P16 1 0.00000000 0.28712100 0.58848900 1.0 P P17 1 0.50000000 0.88099100 0.70833500 1.0 P P18 1 0.50000000 0.71063600 0.40401900 1.0 P P19 1 0.50000000 0.40195800 0.88692300 1.0 P P20 1 0.00000000 0.99697700 0.01026300 1.0