# generated using pymatgen data_Sc4Mn19CrP12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.51790425 _cell_length_b 10.73968920 _cell_length_c 12.18892874 _cell_angle_alpha 89.95527091 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4Mn19CrP12 _chemical_formula_sum 'Sc4 Mn19 Cr1 P12' _cell_volume 460.51219363 _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 Sc Sc0 1 0.25000000 0.58872182 0.70910215 1.0 Sc Sc1 1 0.25000000 0.91220223 0.20662188 1.0 Sc Sc2 1 0.75000000 0.41274190 0.29149644 1.0 Sc Sc3 1 0.75000000 0.08761762 0.79247943 1.0 Mn Mn4 1 0.25000000 0.78493084 0.47809800 1.0 Mn Mn5 1 0.75000000 0.28198988 0.02097034 1.0 Mn Mn6 1 0.75000000 0.21553619 0.52177415 1.0 Mn Mn7 1 0.25000000 0.41050419 0.49260978 1.0 Mn Mn8 1 0.25000000 0.08600580 0.99384515 1.0 Mn Mn9 1 0.75000000 0.59030410 0.50680800 1.0 Mn Mn10 1 0.75000000 0.90913756 0.00477088 1.0 Mn Mn11 1 0.25000000 0.20968648 0.18199424 1.0 Mn Mn12 1 0.25000000 0.28966624 0.68274952 1.0 Mn Mn13 1 0.75000000 0.78931142 0.81931624 1.0 Mn Mn14 1 0.75000000 0.71229677 0.31495077 1.0 Mn Mn15 1 0.25000000 0.88194376 0.69449698 1.0 Mn Mn16 1 0.25000000 0.61689852 0.19123371 1.0 Mn Mn17 1 0.75000000 0.11626374 0.30681816 1.0 Mn Mn18 1 0.75000000 0.38494358 0.80787059 1.0 Mn Mn19 1 0.25000000 0.46418458 0.93478733 1.0 Mn Mn20 1 0.25000000 0.03715823 0.43481728 1.0 Mn Mn21 1 0.75000000 0.53619787 0.06606552 1.0 Mn Mn22 1 0.75000000 0.96275205 0.56571501 1.0 Cr Cr23 1 0.25000000 0.71816132 0.98053392 1.0 P P24 1 0.25000000 0.41199372 0.11995079 1.0 P P25 1 0.25000000 0.08713015 0.62096525 1.0 P P26 1 0.75000000 0.59079926 0.88217416 1.0 P P27 1 0.75000000 0.91284690 0.37964846 1.0 P P28 1 0.25000000 0.26034849 0.87348466 1.0 P P29 1 0.25000000 0.23970523 0.37294053 1.0 P P30 1 0.75000000 0.74017203 0.12347266 1.0 P P31 1 0.75000000 0.76002209 0.62768716 1.0 P P32 1 0.25000000 0.58550186 0.37845043 1.0 P P33 1 0.25000000 0.91376969 0.88012138 1.0 P P34 1 0.75000000 0.41634023 0.62089213 1.0 P P35 1 0.75000000 0.08221668 0.12028794 1.0