# generated using pymatgen data_CaNiGe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.05554515 _cell_length_b 4.21248772 _cell_length_c 8.79981804 _cell_angle_alpha 103.84822999 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaNiGe2 _chemical_formula_sum 'Ca2 Ni2 Ge4' _cell_volume 145.96573147 _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 Ca Ca0 1 0.25000000 0.89111347 0.78222694 1.0 Ca Ca1 1 0.75000000 0.10888653 0.21777306 1.0 Ni Ni2 1 0.75000000 0.32138692 0.64277383 1.0 Ni Ni3 1 0.25000000 0.67861308 0.35722617 1.0 Ge Ge4 1 0.75000000 0.74997142 0.49994183 1.0 Ge Ge5 1 0.25000000 0.25002858 0.50005817 1.0 Ge Ge6 1 0.25000000 0.54293775 0.08587449 1.0 Ge Ge7 1 0.75000000 0.45706225 0.91412551 1.0