# generated using pymatgen data_Cr7C3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.93797934 _cell_length_b 13.93797934 _cell_length_c 4.47658100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999689 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr7C3 _chemical_formula_sum 'Cr56 C24' _cell_volume 753.14175416 _cell_formula_units_Z 8 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 Cr Cr0 1 0.33333300 0.66666700 0.78198300 1.0 Cr Cr1 1 0.66666700 0.33333300 0.28198300 1.0 Cr Cr2 1 0.06129200 0.93870800 0.05607900 1.0 Cr Cr3 1 0.87741700 0.93870800 0.05607900 1.0 Cr Cr4 1 0.06129200 0.12258300 0.05607900 1.0 Cr Cr5 1 0.93870800 0.06129200 0.55607900 1.0 Cr Cr6 1 0.12258300 0.06129200 0.55607900 1.0 Cr Cr7 1 0.93870800 0.87741700 0.55607900 1.0 Cr Cr8 1 0.16679700 0.33359400 0.25822100 1.0 Cr Cr9 1 0.16679700 0.83320300 0.25822100 1.0 Cr Cr10 1 0.66640600 0.83320300 0.25822100 1.0 Cr Cr11 1 0.83320300 0.66640600 0.75822100 1.0 Cr Cr12 1 0.83320300 0.16679700 0.75822100 1.0 Cr Cr13 1 0.33359400 0.16679700 0.75822100 1.0 Cr Cr14 1 0.22756800 0.45513600 0.74902200 1.0 Cr Cr15 1 0.22756800 0.77243200 0.74902200 1.0 Cr Cr16 1 0.54486400 0.77243200 0.74902200 1.0 Cr Cr17 1 0.77243200 0.54486400 0.24902200 1.0 Cr Cr18 1 0.77243200 0.22756800 0.24902200 1.0 Cr Cr19 1 0.45513600 0.22756800 0.24902200 1.0 Cr Cr20 1 0.27294300 0.54588600 0.25275000 1.0 Cr Cr21 1 0.27294300 0.72705700 0.25275000 1.0 Cr Cr22 1 0.45411400 0.72705700 0.25275000 1.0 Cr Cr23 1 0.72705700 0.45411400 0.75275000 1.0 Cr Cr24 1 0.72705700 0.27294300 0.75275000 1.0 Cr Cr25 1 0.54588600 0.27294300 0.75275000 1.0 Cr Cr26 1 0.56174500 0.12349000 0.44797300 1.0 Cr Cr27 1 0.56174500 0.43825500 0.44797300 1.0 Cr Cr28 1 0.87651000 0.43825500 0.44797300 1.0 Cr Cr29 1 0.43825500 0.87651000 0.94797300 1.0 Cr Cr30 1 0.43825500 0.56174500 0.94797300 1.0 Cr Cr31 1 0.12349000 0.56174500 0.94797300 1.0 Cr Cr32 1 0.27159000 0.04451900 0.25683000 1.0 Cr Cr33 1 0.77292900 0.72841000 0.25683000 1.0 Cr Cr34 1 0.95548100 0.22707100 0.25683000 1.0 Cr Cr35 1 0.77292900 0.04451900 0.25683000 1.0 Cr Cr36 1 0.95548100 0.72841000 0.25683000 1.0 Cr Cr37 1 0.27159000 0.22707100 0.25683000 1.0 Cr Cr38 1 0.72841000 0.95548100 0.75683000 1.0 Cr Cr39 1 0.22707100 0.27159000 0.75683000 1.0 Cr Cr40 1 0.04451900 0.77292900 0.75683000 1.0 Cr Cr41 1 0.22707100 0.95548100 0.75683000 1.0 Cr Cr42 1 0.04451900 0.27159000 0.75683000 1.0 Cr Cr43 1 0.72841000 0.77292900 0.75683000 1.0 Cr Cr44 1 0.43741900 0.06215400 0.94744900 1.0 Cr Cr45 1 0.62473600 0.56258100 0.94744900 1.0 Cr Cr46 1 0.93784600 0.37526400 0.94744900 1.0 Cr Cr47 1 0.62473600 0.06215400 0.94744900 1.0 Cr Cr48 1 0.93784600 0.56258100 0.94744900 1.0 Cr Cr49 1 0.43741900 0.37526400 0.94744900 1.0 Cr Cr50 1 0.56258100 0.93784600 0.44744900 1.0 Cr Cr51 1 0.37526400 0.43741900 0.44744900 1.0 Cr Cr52 1 0.06215400 0.62473600 0.44744900 1.0 Cr Cr53 1 0.37526400 0.93784600 0.44744900 1.0 Cr Cr54 1 0.06215400 0.43741900 0.44744900 1.0 Cr Cr55 1 0.56258100 0.62473600 0.44744900 1.0 C C56 1 0.09419900 0.18839700 0.46556700 1.0 C C57 1 0.09419900 0.90580100 0.46556700 1.0 C C58 1 0.81160300 0.90580100 0.46556700 1.0 C C59 1 0.90580100 0.81160300 0.96556700 1.0 C C60 1 0.90580100 0.09419900 0.96556700 1.0 C C61 1 0.18839700 0.09419900 0.96556700 1.0 C C62 1 0.40542300 0.81084700 0.53665600 1.0 C C63 1 0.40542300 0.59457700 0.53665600 1.0 C C64 1 0.18915300 0.59457700 0.53665600 1.0 C C65 1 0.59457700 0.18915300 0.03665600 1.0 C C66 1 0.59457700 0.40542300 0.03665600 1.0 C C67 1 0.81084700 0.40542300 0.03665600 1.0 C C68 1 0.40668200 0.09417000 0.53212500 1.0 C C69 1 0.68748900 0.59331800 0.53212500 1.0 C C70 1 0.90583000 0.31251100 0.53212500 1.0 C C71 1 0.68748900 0.09417000 0.53212500 1.0 C C72 1 0.90583000 0.59331800 0.53212500 1.0 C C73 1 0.40668200 0.31251100 0.53212500 1.0 C C74 1 0.59331800 0.90583000 0.03212500 1.0 C C75 1 0.31251100 0.40668200 0.03212500 1.0 C C76 1 0.09417000 0.68748900 0.03212500 1.0 C C77 1 0.31251100 0.90583000 0.03212500 1.0 C C78 1 0.09417000 0.40668200 0.03212500 1.0 C C79 1 0.59331800 0.68748900 0.03212500 1.0