# generated using pymatgen data_ErMn4MoP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.61515617 _cell_length_b 10.79581136 _cell_length_c 12.28159797 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErMn4MoP3 _chemical_formula_sum 'Er4 Mn16 Mo4 P12' _cell_volume 479.33288736 _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 Er Er0 1 0.25000000 0.58827815 0.70670430 1.0 Er Er1 1 0.25000000 0.91172185 0.20670430 1.0 Er Er2 1 0.75000000 0.41172185 0.29329570 1.0 Er Er3 1 0.75000000 0.08827815 0.79329570 1.0 Mn Mn4 1 0.25000000 0.41159836 0.49494088 1.0 Mn Mn5 1 0.25000000 0.08840264 0.99494088 1.0 Mn Mn6 1 0.75000000 0.58840164 0.50505912 1.0 Mn Mn7 1 0.75000000 0.91159836 0.00505912 1.0 Mn Mn8 1 0.25000000 0.20994529 0.18439193 1.0 Mn Mn9 1 0.25000000 0.29005471 0.68439193 1.0 Mn Mn10 1 0.75000000 0.79005471 0.81560807 1.0 Mn Mn11 1 0.75000000 0.70994529 0.31560807 1.0 Mn Mn12 1 0.25000000 0.88498749 0.69147554 1.0 Mn Mn13 1 0.25000000 0.61501251 0.19147554 1.0 Mn Mn14 1 0.75000000 0.11501251 0.30852446 1.0 Mn Mn15 1 0.75000000 0.38498749 0.80852446 1.0 Mn Mn16 1 0.25000000 0.46538867 0.93565800 1.0 Mn Mn17 1 0.25000000 0.03461133 0.43565800 1.0 Mn Mn18 1 0.75000000 0.53461133 0.06434200 1.0 Mn Mn19 1 0.75000000 0.96538867 0.56434200 1.0 Mo Mo20 1 0.25000000 0.71353610 0.97976706 1.0 Mo Mo21 1 0.25000000 0.78646390 0.47976706 1.0 Mo Mo22 1 0.75000000 0.28646390 0.02023294 1.0 Mo Mo23 1 0.75000000 0.21353610 0.52023294 1.0 P P24 1 0.25000000 0.41269889 0.11897393 1.0 P P25 1 0.25000000 0.08730111 0.61897393 1.0 P P26 1 0.75000000 0.58730111 0.88102607 1.0 P P27 1 0.75000000 0.91269889 0.38102607 1.0 P P28 1 0.25000000 0.26366345 0.87399386 1.0 P P29 1 0.25000000 0.23633655 0.37399386 1.0 P P30 1 0.75000000 0.73633655 0.12600614 1.0 P P31 1 0.75000000 0.76366345 0.62600614 1.0 P P32 1 0.25000000 0.58829111 0.38141920 1.0 P P33 1 0.25000000 0.91170889 0.88141920 1.0 P P34 1 0.75000000 0.41170889 0.61858080 1.0 P P35 1 0.75000000 0.08829111 0.11858080 1.0