# generated using pymatgen data_SmMnCo4P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.71063767 _cell_length_b 10.35272638 _cell_length_c 11.87786631 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmMnCo4P3 _chemical_formula_sum 'Sm4 Mn4 Co16 P12' _cell_volume 456.29080601 _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 Sm Sm0 1 0.25000000 0.58261144 0.70447023 1.0 Sm Sm1 1 0.25000000 0.91738856 0.20447023 1.0 Sm Sm2 1 0.75000000 0.41738856 0.29552977 1.0 Sm Sm3 1 0.75000000 0.08261144 0.79552977 1.0 Mn Mn4 1 0.25000000 0.70235866 0.99140844 1.0 Mn Mn5 1 0.25000000 0.79764134 0.49140844 1.0 Mn Mn6 1 0.75000000 0.29764134 0.00859156 1.0 Mn Mn7 1 0.75000000 0.20235866 0.50859156 1.0 Co Co8 1 0.25000000 0.40456558 0.48994969 1.0 Co Co9 1 0.25000000 0.09543442 0.98994969 1.0 Co Co10 1 0.75000000 0.59543442 0.51005031 1.0 Co Co11 1 0.75000000 0.90456558 0.01005031 1.0 Co Co12 1 0.25000000 0.22377822 0.17002610 1.0 Co Co13 1 0.25000000 0.27622178 0.67002610 1.0 Co Co14 1 0.75000000 0.77622178 0.82997390 1.0 Co Co15 1 0.75000000 0.72377822 0.32997390 1.0 Co Co16 1 0.25000000 0.88002165 0.70262743 1.0 Co Co17 1 0.25000000 0.61997835 0.20262743 1.0 Co Co18 1 0.75000000 0.11997835 0.29737257 1.0 Co Co19 1 0.75000000 0.38002165 0.79737257 1.0 Co Co20 1 0.25000000 0.46473475 0.93216690 1.0 Co Co21 1 0.25000000 0.03526525 0.43216690 1.0 Co Co22 1 0.75000000 0.53526525 0.06783310 1.0 Co Co23 1 0.75000000 0.96473475 0.56783310 1.0 P P24 1 0.25000000 0.42612414 0.11280128 1.0 P P25 1 0.25000000 0.07387586 0.61280128 1.0 P P26 1 0.75000000 0.57387586 0.88719872 1.0 P P27 1 0.75000000 0.92612414 0.38719872 1.0 P P28 1 0.25000000 0.27512492 0.85864528 1.0 P P29 1 0.25000000 0.22487508 0.35864528 1.0 P P30 1 0.75000000 0.72487508 0.14135472 1.0 P P31 1 0.75000000 0.77512492 0.64135472 1.0 P P32 1 0.25000000 0.59820197 0.39237380 1.0 P P33 1 0.25000000 0.90179803 0.89237380 1.0 P P34 1 0.75000000 0.40179803 0.60762620 1.0 P P35 1 0.75000000 0.09820197 0.10762620 1.0