# generated using pymatgen data_CaY3(ZnSi3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.08061360 _cell_length_b 4.10103537 _cell_length_c 13.94341451 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaY3(ZnSi3)2 _chemical_formula_sum 'Ca1 Y3 Zn2 Si6' _cell_volume 233.33942599 _cell_formula_units_Z 1 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 0.50000000 0.50000000 0.00336908 1.0 Y Y1 1 0.00000000 0.00000000 0.50411090 1.0 Y Y2 1 0.50000000 0.00000000 0.74416257 1.0 Y Y3 1 0.00000000 0.50000000 0.24855547 1.0 Zn Zn4 1 0.00000000 0.00000000 0.91457842 1.0 Zn Zn5 1 0.50000000 0.50000000 0.41599722 1.0 Si Si6 1 0.00000000 0.50000000 0.83079567 1.0 Si Si7 1 0.50000000 0.00000000 0.33471895 1.0 Si Si8 1 0.00000000 0.00000000 0.08542621 1.0 Si Si9 1 0.50000000 0.50000000 0.58190600 1.0 Si Si10 1 0.50000000 0.00000000 0.16996398 1.0 Si Si11 1 0.00000000 0.50000000 0.66641352 1.0