# generated using pymatgen data_Zn3As2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.64813095 _cell_length_b 14.64813095 _cell_length_c 14.64813095 _cell_angle_alpha 132.01612937 _cell_angle_beta 132.01612937 _cell_angle_gamma 70.20355349 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zn3As2 _chemical_formula_sum 'Zn48 As32' _cell_volume 1700.52062036 _cell_formula_units_Z 16 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 Zn Zn0 1 0.43476700 0.45723500 0.27284900 1.0 Zn Zn1 1 0.93476700 0.66191800 0.97753100 1.0 Zn Zn2 1 0.70723500 0.18476700 0.77284900 1.0 Zn Zn3 1 0.20723500 0.43438700 0.52246900 1.0 Zn Zn4 1 0.31523300 0.79276500 0.22715100 1.0 Zn Zn5 1 0.81523300 0.58808200 0.52246900 1.0 Zn Zn6 1 0.04276500 0.06523300 0.72715100 1.0 Zn Zn7 1 0.54276500 0.81561300 0.97753100 1.0 Zn Zn8 1 0.68438700 0.95723500 0.02246900 1.0 Zn Zn9 1 0.18438700 0.16191800 0.72715100 1.0 Zn Zn10 1 0.91191800 0.68476700 0.47753100 1.0 Zn Zn11 1 0.41191800 0.93438700 0.22715100 1.0 Zn Zn12 1 0.06561300 0.29276500 0.47753100 1.0 Zn Zn13 1 0.56561300 0.08808200 0.77284900 1.0 Zn Zn14 1 0.83808200 0.56523300 0.02246900 1.0 Zn Zn15 1 0.33808200 0.31561300 0.27284900 1.0 Zn Zn16 1 0.69280800 0.42376300 0.50200400 1.0 Zn Zn17 1 0.19280800 0.69080400 0.26904500 1.0 Zn Zn18 1 0.67376300 0.44280800 0.00200400 1.0 Zn Zn19 1 0.17376300 0.17175900 0.23095500 1.0 Zn Zn20 1 0.05719200 0.82623700 0.99799600 1.0 Zn Zn21 1 0.55719200 0.55919600 0.23095500 1.0 Zn Zn22 1 0.07623700 0.80719200 0.49799600 1.0 Zn Zn23 1 0.57623700 0.07824100 0.26904500 1.0 Zn Zn24 1 0.42175900 0.92376300 0.73095500 1.0 Zn Zn25 1 0.92175900 0.19080400 0.49799600 1.0 Zn Zn26 1 0.94080400 0.94280800 0.76904500 1.0 Zn Zn27 1 0.44080400 0.67175900 0.99799600 1.0 Zn Zn28 1 0.32824100 0.32623700 0.76904500 1.0 Zn Zn29 1 0.82824100 0.05919600 0.00200400 1.0 Zn Zn30 1 0.80919600 0.30719200 0.73095500 1.0 Zn Zn31 1 0.30919600 0.57824100 0.50200400 1.0 Zn Zn32 1 0.45927100 0.20012000 0.01557200 1.0 Zn Zn33 1 0.95927100 0.94369900 0.25915100 1.0 Zn Zn34 1 0.45012000 0.20927100 0.51557200 1.0 Zn Zn35 1 0.95012000 0.43454800 0.24084900 1.0 Zn Zn36 1 0.29072900 0.04988000 0.48442800 1.0 Zn Zn37 1 0.79072900 0.30630100 0.24084900 1.0 Zn Zn38 1 0.29988000 0.04072900 0.98442800 1.0 Zn Zn39 1 0.79988000 0.81545200 0.25915100 1.0 Zn Zn40 1 0.68454800 0.70012000 0.74084900 1.0 Zn Zn41 1 0.18454800 0.44369900 0.98442800 1.0 Zn Zn42 1 0.19369900 0.70927100 0.75915100 1.0 Zn Zn43 1 0.69369900 0.93454800 0.48442800 1.0 Zn Zn44 1 0.06545200 0.54988000 0.75915100 1.0 Zn Zn45 1 0.56545200 0.80630100 0.51557200 1.0 Zn Zn46 1 0.55630100 0.54072900 0.74084900 1.0 Zn Zn47 1 0.05630100 0.31545200 0.01557200 1.0 As As48 1 0.00000000 0.00000000 0.00000000 1.0 As As49 1 0.50000000 0.50000000 0.00000000 1.0 As As50 1 0.25000000 0.75000000 0.50000000 1.0 As As51 1 0.75000000 0.25000000 0.50000000 1.0 As As52 1 0.25000000 0.25000000 0.00000000 1.0 As As53 1 0.75000000 0.75000000 0.00000000 1.0 As As54 1 0.50000000 0.00000000 0.50000000 1.0 As As55 1 0.00000000 0.50000000 0.50000000 1.0 As As56 1 0.37500000 0.12500000 0.75000000 1.0 As As57 1 0.87500000 0.12500000 0.25000000 1.0 As As58 1 0.37500000 0.12500000 0.25000000 1.0 As As59 1 0.87500000 0.62500000 0.25000000 1.0 As As60 1 0.87500000 0.62500000 0.75000000 1.0 As As61 1 0.37500000 0.62500000 0.25000000 1.0 As As62 1 0.37500000 0.62500000 0.75000000 1.0 As As63 1 0.87500000 0.12500000 0.75000000 1.0 As As64 1 0.10509700 0.87500000 0.73009700 1.0 As As65 1 0.60509700 0.87500000 0.23009700 1.0 As As66 1 0.12500000 0.85509700 0.23009700 1.0 As As67 1 0.62500000 0.39490300 0.26990300 1.0 As As68 1 0.64490300 0.37500000 0.76990300 1.0 As As69 1 0.14490300 0.37500000 0.26990300 1.0 As As70 1 0.12500000 0.35509700 0.73009700 1.0 As As71 1 0.62500000 0.89490300 0.76990300 1.0 As As72 1 0.50937300 0.50937300 0.51874500 1.0 As As73 1 0.00937300 0.49062700 0.00000000 1.0 As As74 1 0.75937300 0.25937300 0.01874500 1.0 As As75 1 0.25937300 0.24062700 0.50000000 1.0 As As76 1 0.24062700 0.74062700 0.98125500 1.0 As As77 1 0.74062700 0.75937300 0.50000000 1.0 As As78 1 0.99062700 0.99062700 0.48125500 1.0 As As79 1 0.49062700 0.00937300 0.00000000 1.0