# generated using pymatgen data_CaAc8Pr11Si16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.14083841 _cell_length_b 8.14083837 _cell_length_c 15.44857753 _cell_angle_alpha 90.15930427 _cell_angle_beta 89.84069694 _cell_angle_gamma 90.07254040 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaAc8Pr11Si16 _chemical_formula_sum 'Ca1 Ac8 Pr11 Si16' _cell_volume 1023.81871071 _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 0.31265651 0.31265651 1.00000000 1.0 Ac Ac1 1 0.36860245 0.01418075 0.45262085 1.0 Ac Ac2 1 0.48589834 0.86793143 0.70307565 1.0 Ac Ac3 1 0.51197589 0.12858150 0.20015739 1.0 Ac Ac4 1 0.86793143 0.48589834 0.29692435 1.0 Ac Ac5 1 0.12858150 0.51197589 0.79984261 1.0 Ac Ac6 1 0.62979220 0.99055049 0.95063721 1.0 Ac Ac7 1 0.01418075 0.36860245 0.54737915 1.0 Ac Ac8 1 0.99055049 0.62979220 0.04936279 1.0 Pr Pr9 1 0.19339462 0.81167012 0.25064679 1.0 Pr Pr10 1 0.81167012 0.19339462 0.74935321 1.0 Pr Pr11 1 0.68977459 0.68977459 0.50000000 1.0 Pr Pr12 1 0.12837220 0.98770692 0.87717227 1.0 Pr Pr13 1 0.51240844 0.62938313 0.12529902 1.0 Pr Pr14 1 0.48294236 0.37122896 0.62622891 1.0 Pr Pr15 1 0.62938313 0.51240844 0.87470098 1.0 Pr Pr16 1 0.37122896 0.48294236 0.37377109 1.0 Pr Pr17 1 0.87059341 0.01431187 0.37592414 1.0 Pr Pr18 1 0.98770692 0.12837220 0.12282773 1.0 Pr Pr19 1 0.01431187 0.87059341 0.62407586 1.0 Si Si20 1 0.19925289 0.16348746 0.70270256 1.0 Si Si21 1 0.33961473 0.70740164 0.94845115 1.0 Si Si22 1 0.66334947 0.29898399 0.45180478 1.0 Si Si23 1 0.70740164 0.33961473 0.05154885 1.0 Si Si24 1 0.29898399 0.66334947 0.54819522 1.0 Si Si25 1 0.79923773 0.83591331 0.20073448 1.0 Si Si26 1 0.16348746 0.19925289 0.29729744 1.0 Si Si27 1 0.83591331 0.79923773 0.79926552 1.0 Si Si28 1 0.28572489 0.91876043 0.06003616 1.0 Si Si29 1 0.57697298 0.78552589 0.30905762 1.0 Si Si30 1 0.42244571 0.21278744 0.81003462 1.0 Si Si31 1 0.78552589 0.57697298 0.69094238 1.0 Si Si32 1 0.21278744 0.42244571 0.18996538 1.0 Si Si33 1 0.71244899 0.07613627 0.56011135 1.0 Si Si34 1 0.91876043 0.28572489 0.93996384 1.0 Si Si35 1 0.07613627 0.71244899 0.43988865 1.0