# generated using pymatgen data_ErThMn12P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.63377666 _cell_length_b 9.63377799 _cell_length_c 3.65694583 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000300 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErThMn12P7 _chemical_formula_sum 'Er1 Th1 Mn12 P7' _cell_volume 293.92894314 _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 Er Er0 1 0.33333300 0.66666700 0.00000000 1.0 Th Th1 1 0.00000000 0.00000000 0.50000000 1.0 Mn Mn2 1 0.04845130 0.28687812 0.00000000 1.0 Mn Mn3 1 0.71312188 0.76157318 0.00000000 1.0 Mn Mn4 1 0.23842682 0.95154870 0.00000000 1.0 Mn Mn5 1 0.54910270 0.05747702 0.00000000 1.0 Mn Mn6 1 0.94252298 0.49162668 0.00000000 1.0 Mn Mn7 1 0.50837332 0.45089730 0.00000000 1.0 Mn Mn8 1 0.62282685 0.89487111 0.50000000 1.0 Mn Mn9 1 0.10512889 0.72795574 0.50000000 1.0 Mn Mn10 1 0.27204426 0.37717315 0.50000000 1.0 Mn Mn11 1 0.79825050 0.23197874 0.50000000 1.0 Mn Mn12 1 0.76802126 0.56627176 0.50000000 1.0 Mn Mn13 1 0.43372824 0.20174950 0.50000000 1.0 P P14 1 0.78571292 0.04526976 0.00000000 1.0 P P15 1 0.95473024 0.74044317 0.00000000 1.0 P P16 1 0.25955683 0.21428708 0.00000000 1.0 P P17 1 0.38223302 0.91491488 0.50000000 1.0 P P18 1 0.08508512 0.46731914 0.50000000 1.0 P P19 1 0.53268086 0.61776698 0.50000000 1.0 P P20 1 0.66666700 0.33333300 0.00000000 1.0