# generated using pymatgen data_Mn2ZnS4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.16220398 _cell_length_b 7.16220398 _cell_length_c 7.16220398 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2ZnS4 _chemical_formula_sum 'Mn4 Zn2 S8' _cell_volume 259.79157226 _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 Mn Mn0 1 0.12500000 0.62500000 0.62500000 1.0 Mn Mn1 1 0.62500000 0.12500000 0.62500000 1.0 Mn Mn2 1 0.62500000 0.62500000 0.12500000 1.0 Mn Mn3 1 0.62500000 0.62500000 0.62500000 1.0 Zn Zn4 1 0.25000000 0.25000000 0.25000000 1.0 Zn Zn5 1 0.00000000 0.00000000 0.00000000 1.0 S S6 1 0.84771400 0.38409500 0.38409500 1.0 S S7 1 0.38409500 0.84771400 0.38409500 1.0 S S8 1 0.38409500 0.38409500 0.84771400 1.0 S S9 1 0.38409500 0.38409500 0.38409500 1.0 S S10 1 0.40228600 0.86590500 0.86590500 1.0 S S11 1 0.86590500 0.40228600 0.86590500 1.0 S S12 1 0.86590500 0.86590500 0.40228600 1.0 S S13 1 0.86590500 0.86590500 0.86590500 1.0