# generated using pymatgen data_SmMn4CrP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.64260805 _cell_length_b 10.91471162 _cell_length_c 12.28176665 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmMn4CrP3 _chemical_formula_sum 'Sm4 Mn16 Cr4 P12' _cell_volume 488.29867969 _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 0.59229150 0.70686890 1.0 Sm Sm1 1 0.25000000 0.90770850 0.20686890 1.0 Sm Sm2 1 0.75000000 0.40770850 0.29313110 1.0 Sm Sm3 1 0.75000000 0.09229150 0.79313110 1.0 Mn Mn4 1 0.25000000 0.41110019 0.49733614 1.0 Mn Mn5 1 0.25000000 0.08889981 0.99733614 1.0 Mn Mn6 1 0.75000000 0.58889981 0.50266386 1.0 Mn Mn7 1 0.75000000 0.91110019 0.00266386 1.0 Mn Mn8 1 0.25000000 0.20472088 0.18409503 1.0 Mn Mn9 1 0.25000000 0.29527912 0.68409503 1.0 Mn Mn10 1 0.75000000 0.79527912 0.81590497 1.0 Mn Mn11 1 0.75000000 0.70472088 0.31590497 1.0 Mn Mn12 1 0.25000000 0.88753067 0.68945546 1.0 Mn Mn13 1 0.25000000 0.61246933 0.18945546 1.0 Mn Mn14 1 0.75000000 0.11246933 0.31054454 1.0 Mn Mn15 1 0.75000000 0.38753067 0.81054454 1.0 Mn Mn16 1 0.25000000 0.46808910 0.93538103 1.0 Mn Mn17 1 0.25000000 0.03191090 0.43538103 1.0 Mn Mn18 1 0.75000000 0.53191090 0.06461897 1.0 Mn Mn19 1 0.75000000 0.96808910 0.56461897 1.0 Cr Cr20 1 0.25000000 0.71891654 0.97914591 1.0 Cr Cr21 1 0.25000000 0.78108346 0.47914591 1.0 Cr Cr22 1 0.75000000 0.28108346 0.02085409 1.0 Cr Cr23 1 0.75000000 0.21891654 0.52085409 1.0 P P24 1 0.25000000 0.40668547 0.11410073 1.0 P P25 1 0.25000000 0.09331453 0.61410073 1.0 P P26 1 0.75000000 0.59331453 0.88589927 1.0 P P27 1 0.75000000 0.90668547 0.38589927 1.0 P P28 1 0.25000000 0.26915935 0.87911649 1.0 P P29 1 0.25000000 0.23084065 0.37911649 1.0 P P30 1 0.75000000 0.73084065 0.12088351 1.0 P P31 1 0.75000000 0.76915935 0.62088351 1.0 P P32 1 0.25000000 0.58826033 0.38137501 1.0 P P33 1 0.25000000 0.91173967 0.88137501 1.0 P P34 1 0.75000000 0.41173967 0.61862499 1.0 P P35 1 0.75000000 0.08826033 0.11862499 1.0