# generated using pymatgen data_Er2Mn9FeP6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.58432984 _cell_length_b 10.82533362 _cell_length_c 12.25987390 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er2Mn9FeP6 _chemical_formula_sum 'Er4 Mn18 Fe2 P12' _cell_volume 475.70231024 _cell_formula_units_Z 2 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 0.25000000 0.59008526 0.70670538 1.0 Er Er1 1 0.25000000 0.90991474 0.20670538 1.0 Er Er2 1 0.75000000 0.40990149 0.29334381 1.0 Er Er3 1 0.75000000 0.09009851 0.79334381 1.0 Mn Mn4 1 0.25000000 0.71678192 0.97786892 1.0 Mn Mn5 1 0.25000000 0.78321808 0.47786892 1.0 Mn Mn6 1 0.75000000 0.28364388 0.02362429 1.0 Mn Mn7 1 0.75000000 0.21635612 0.52362429 1.0 Mn Mn8 1 0.25000000 0.41007655 0.49447578 1.0 Mn Mn9 1 0.25000000 0.08992345 0.99447578 1.0 Mn Mn10 1 0.75000000 0.59064462 0.50521190 1.0 Mn Mn11 1 0.75000000 0.90935538 0.00521190 1.0 Mn Mn12 1 0.25000000 0.20814864 0.18310882 1.0 Mn Mn13 1 0.25000000 0.29185136 0.68310882 1.0 Mn Mn14 1 0.75000000 0.79096115 0.81578971 1.0 Mn Mn15 1 0.75000000 0.70903885 0.31578971 1.0 Mn Mn16 1 0.25000000 0.88731226 0.68855108 1.0 Mn Mn17 1 0.25000000 0.61268774 0.18855108 1.0 Mn Mn18 1 0.75000000 0.11421327 0.30956561 1.0 Mn Mn19 1 0.75000000 0.38578673 0.80956561 1.0 Mn Mn20 1 0.25000000 0.46683366 0.93730198 1.0 Mn Mn21 1 0.25000000 0.03316634 0.43730198 1.0 Fe Fe22 1 0.75000000 0.53336985 0.06473824 1.0 Fe Fe23 1 0.75000000 0.96663015 0.56473824 1.0 P P24 1 0.25000000 0.40757845 0.11842106 1.0 P P25 1 0.25000000 0.09242155 0.61842106 1.0 P P26 1 0.75000000 0.59015775 0.88178118 1.0 P P27 1 0.75000000 0.90984225 0.38178118 1.0 P P28 1 0.25000000 0.26567673 0.87527788 1.0 P P29 1 0.25000000 0.23432327 0.37527788 1.0 P P30 1 0.75000000 0.73514385 0.12452320 1.0 P P31 1 0.75000000 0.76485615 0.62452320 1.0 P P32 1 0.25000000 0.58624197 0.37950254 1.0 P P33 1 0.25000000 0.91375803 0.87950254 1.0 P P34 1 0.75000000 0.41501590 0.62020860 1.0 P P35 1 0.75000000 0.08498410 0.12020860 1.0