# generated using pymatgen data_Cr2CoSeS3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.98677440 _cell_length_b 6.99961750 _cell_length_c 6.99561386 _cell_angle_alpha 90.00000000 _cell_angle_beta 59.95813298 _cell_angle_gamma 120.06082586 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr2CoSeS3 _chemical_formula_sum 'Cr4 Co2 Se2 S6' _cell_volume 241.53848487 _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 Cr Cr0 1 0.51412100 0.50740900 0.99294000 1.0 Cr Cr1 1 0.51412100 0.00671200 0.99294000 1.0 Cr Cr2 1 0.99874300 0.99937100 0.51935900 1.0 Cr Cr3 1 0.99874300 0.99937100 0.98189800 1.0 Co Co4 1 0.71147700 0.35573900 0.39426100 1.0 Co Co5 1 0.26641600 0.63320800 0.61679200 1.0 Se Se6 1 0.00236200 0.75869700 0.24881900 1.0 Se Se7 1 0.00236200 0.24366600 0.24881900 1.0 S S8 1 0.48396400 0.24198200 0.77401800 1.0 S S9 1 0.48396400 0.24198200 0.24201800 1.0 S S10 1 0.99668700 0.24620500 0.75165700 1.0 S S11 1 0.99668700 0.75048200 0.75165700 1.0 S S12 1 0.51517700 0.75758800 0.22687600 1.0 S S13 1 0.51517700 0.75758800 0.75794700 1.0