# generated using pymatgen data_Mg2Co12As7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.65529500 _cell_length_b 12.02318200 _cell_length_c 24.88085300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2Co12As7 _chemical_formula_sum 'Mg8 Co48 As28' _cell_volume 1093.47062085 _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 Mg Mg0 1 0.75000000 0.31021300 0.88441000 1.0 Mg Mg1 1 0.25000000 0.18978700 0.38441000 1.0 Mg Mg2 1 0.25000000 0.68978700 0.11559000 1.0 Mg Mg3 1 0.25000000 0.71360300 0.82098700 1.0 Mg Mg4 1 0.75000000 0.81021300 0.61559000 1.0 Mg Mg5 1 0.75000000 0.28639700 0.17901300 1.0 Mg Mg6 1 0.75000000 0.78639700 0.32098700 1.0 Mg Mg7 1 0.25000000 0.21360300 0.67901300 1.0 Co Co8 1 0.75000000 0.79211500 0.18802700 1.0 Co Co9 1 0.25000000 0.47413600 0.18586900 1.0 Co Co10 1 0.25000000 0.66998500 0.23921600 1.0 Co Co11 1 0.25000000 0.99184600 0.60851800 1.0 Co Co12 1 0.75000000 0.29211500 0.31197300 1.0 Co Co13 1 0.75000000 0.50180700 0.27053000 1.0 Co Co14 1 0.25000000 0.97413600 0.31413100 1.0 Co Co15 1 0.25000000 0.44007800 0.62224400 1.0 Co Co16 1 0.75000000 0.33001500 0.76078400 1.0 Co Co17 1 0.25000000 0.67324400 0.95969700 1.0 Co Co18 1 0.25000000 0.19426800 0.09070000 1.0 Co Co19 1 0.25000000 0.49819400 0.72947000 1.0 Co Co20 1 0.75000000 0.32675600 0.04030300 1.0 Co Co21 1 0.75000000 0.51457900 0.54375900 1.0 Co Co22 1 0.75000000 0.00180600 0.22947000 1.0 Co Co23 1 0.75000000 0.55992200 0.37775600 1.0 Co Co24 1 0.25000000 0.17324400 0.54030300 1.0 Co Co25 1 0.25000000 0.94007800 0.87775600 1.0 Co Co26 1 0.75000000 0.08018800 0.84885600 1.0 Co Co27 1 0.25000000 0.68712300 0.51421100 1.0 Co Co28 1 0.75000000 0.01457900 0.95624100 1.0 Co Co29 1 0.75000000 0.52586400 0.81413100 1.0 Co Co30 1 0.75000000 0.31287700 0.48578900 1.0 Co Co31 1 0.75000000 0.81287700 0.01421100 1.0 Co Co32 1 0.75000000 0.05992200 0.12224400 1.0 Co Co33 1 0.75000000 0.80573200 0.90930000 1.0 Co Co34 1 0.25000000 0.51060500 0.03619200 1.0 Co Co35 1 0.75000000 0.83001500 0.73921600 1.0 Co Co36 1 0.25000000 0.18712300 0.98578900 1.0 Co Co37 1 0.25000000 0.48542100 0.45624100 1.0 Co Co38 1 0.75000000 0.00815400 0.39148200 1.0 Co Co39 1 0.25000000 0.49184600 0.89148200 1.0 Co Co40 1 0.25000000 0.01060500 0.46380800 1.0 Co Co41 1 0.25000000 0.41981200 0.34885600 1.0 Co Co42 1 0.75000000 0.50815400 0.10851800 1.0 Co Co43 1 0.25000000 0.16998500 0.26078400 1.0 Co Co44 1 0.75000000 0.58018800 0.65114400 1.0 Co Co45 1 0.75000000 0.02586400 0.68586900 1.0 Co Co46 1 0.25000000 0.98542100 0.04375900 1.0 Co Co47 1 0.25000000 0.99819300 0.77053000 1.0 Co Co48 1 0.25000000 0.91981200 0.15114400 1.0 Co Co49 1 0.25000000 0.20788500 0.81197300 1.0 Co Co50 1 0.75000000 0.48939500 0.96380800 1.0 Co Co51 1 0.75000000 0.82675600 0.45969700 1.0 Co Co52 1 0.25000000 0.70788500 0.68802700 1.0 Co Co53 1 0.25000000 0.69426800 0.40930000 1.0 Co Co54 1 0.75000000 0.30573200 0.59070000 1.0 Co Co55 1 0.75000000 0.98939500 0.53619200 1.0 As As56 1 0.75000000 0.12704400 0.47003800 1.0 As As57 1 0.75000000 0.62704400 0.02996200 1.0 As As58 1 0.75000000 0.89414900 0.82473600 1.0 As As59 1 0.25000000 0.37309600 0.53581200 1.0 As As60 1 0.25000000 0.10585100 0.17526400 1.0 As As61 1 0.25000000 0.87295600 0.52996200 1.0 As As62 1 0.25000000 0.86188800 0.23969400 1.0 As As63 1 0.75000000 0.10039700 0.31039100 1.0 As As64 1 0.75000000 0.11895100 0.60400400 1.0 As As65 1 0.25000000 0.37295600 0.97003800 1.0 As As66 1 0.25000000 0.88104900 0.39599600 1.0 As As67 1 0.75000000 0.37423300 0.40048800 1.0 As As68 1 0.75000000 0.13811200 0.76030600 1.0 As As69 1 0.25000000 0.87309600 0.96418800 1.0 As As70 1 0.25000000 0.12576700 0.90048800 1.0 As As71 1 0.75000000 0.39414900 0.67526400 1.0 As As72 1 0.75000000 0.62690400 0.46418800 1.0 As As73 1 0.25000000 0.38104900 0.10400400 1.0 As As74 1 0.25000000 0.62576700 0.59951200 1.0 As As75 1 0.25000000 0.89960300 0.68960900 1.0 As As76 1 0.75000000 0.61895100 0.89599600 1.0 As As77 1 0.25000000 0.36188800 0.26030600 1.0 As As78 1 0.75000000 0.87423300 0.09951200 1.0 As As79 1 0.25000000 0.39960300 0.81039100 1.0 As As80 1 0.75000000 0.60039700 0.18960900 1.0 As As81 1 0.75000000 0.63811200 0.73969400 1.0 As As82 1 0.25000000 0.60585100 0.32473600 1.0 As As83 1 0.75000000 0.12690400 0.03581200 1.0