# generated using pymatgen data_MgCrCo4P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.54584348 _cell_length_b 10.15724791 _cell_length_c 11.67494659 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCrCo4P3 _chemical_formula_sum 'Mg4 Cr4 Co16 P12' _cell_volume 420.48500783 _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 0.25000000 0.91936557 0.20563059 1.0 Mg Mg1 1 0.75000000 0.08063443 0.79436941 1.0 Mg Mg2 1 0.75000000 0.41936557 0.29436941 1.0 Mg Mg3 1 0.25000000 0.58063443 0.70563059 1.0 Cr Cr4 1 0.25000000 0.79005395 0.49111607 1.0 Cr Cr5 1 0.75000000 0.20994605 0.50888393 1.0 Cr Cr6 1 0.75000000 0.29005395 0.00888393 1.0 Cr Cr7 1 0.25000000 0.70994605 0.99111607 1.0 Co Co8 1 0.25000000 0.09478069 0.98347234 1.0 Co Co9 1 0.75000000 0.90521931 0.01652766 1.0 Co Co10 1 0.75000000 0.59478069 0.51652766 1.0 Co Co11 1 0.25000000 0.40521931 0.48347234 1.0 Co Co12 1 0.25000000 0.27990257 0.67244900 1.0 Co Co13 1 0.75000000 0.72009743 0.32755100 1.0 Co Co14 1 0.75000000 0.77990257 0.82755100 1.0 Co Co15 1 0.25000000 0.22009743 0.17244900 1.0 Co Co16 1 0.25000000 0.61503670 0.20280185 1.0 Co Co17 1 0.75000000 0.38496330 0.79719815 1.0 Co Co18 1 0.75000000 0.11503670 0.29719815 1.0 Co Co19 1 0.25000000 0.88496330 0.70280185 1.0 Co Co20 1 0.25000000 0.03660704 0.43140725 1.0 Co Co21 1 0.75000000 0.96339296 0.56859275 1.0 Co Co22 1 0.75000000 0.53660704 0.06859275 1.0 Co Co23 1 0.25000000 0.46339296 0.93140725 1.0 P P24 1 0.25000000 0.07935991 0.61573744 1.0 P P25 1 0.75000000 0.92064009 0.38426256 1.0 P P26 1 0.75000000 0.57935991 0.88426256 1.0 P P27 1 0.25000000 0.42064009 0.11573744 1.0 P P28 1 0.25000000 0.23562876 0.36042435 1.0 P P29 1 0.75000000 0.76437124 0.63957565 1.0 P P30 1 0.75000000 0.73562876 0.13957565 1.0 P P31 1 0.25000000 0.26437124 0.86042435 1.0 P P32 1 0.25000000 0.90902236 0.88856694 1.0 P P33 1 0.75000000 0.09097764 0.11143306 1.0 P P34 1 0.75000000 0.40902236 0.61143306 1.0 P P35 1 0.25000000 0.59097764 0.38856694 1.0