# generated using pymatgen data_Si4NiO10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.33553430 _cell_length_b 7.33553430 _cell_length_c 15.84352600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.10180015 _symmetry_Int_Tables_number 1 _chemical_formula_structural Si4NiO10 _chemical_formula_sum 'Si16 Ni4 O40' _cell_volume 852.53979382 _cell_formula_units_Z 4 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 Si Si0 1 0.17737500 0.25644500 0.90001800 1.0 Si Si1 1 0.82262500 0.74355500 0.90001800 1.0 Si Si2 1 0.25644500 0.17737500 0.09998200 1.0 Si Si3 1 0.75648600 0.32253100 0.90015700 1.0 Si Si4 1 0.24351400 0.67746900 0.90015700 1.0 Si Si5 1 0.32253100 0.75648600 0.09984300 1.0 Si Si6 1 0.67746900 0.24351400 0.09984300 1.0 Si Si7 1 0.74355500 0.82262500 0.09998200 1.0 Si Si8 1 0.32262500 0.24355500 0.59998200 1.0 Si Si9 1 0.67737500 0.75644500 0.59998200 1.0 Si Si10 1 0.24355500 0.32262500 0.40001800 1.0 Si Si11 1 0.74351400 0.17746900 0.59984300 1.0 Si Si12 1 0.25648600 0.82253100 0.59984300 1.0 Si Si13 1 0.17746900 0.74351400 0.40015700 1.0 Si Si14 1 0.82253100 0.25648600 0.40015700 1.0 Si Si15 1 0.75644500 0.67737500 0.40001800 1.0 Ni Ni16 1 0.50000000 0.00000000 0.84128200 1.0 Ni Ni17 1 0.00000000 0.50000000 0.15871800 1.0 Ni Ni18 1 0.00000000 0.50000000 0.65871800 1.0 Ni Ni19 1 0.50000000 0.00000000 0.34128200 1.0 O O20 1 0.27959800 0.10319700 0.84207800 1.0 O O21 1 0.72040200 0.89680300 0.84207800 1.0 O O22 1 0.10319700 0.27959800 0.15792200 1.0 O O23 1 0.60710800 0.22409100 0.83835100 1.0 O O24 1 0.39289200 0.77590900 0.83835100 1.0 O O25 1 0.22409100 0.60710800 0.16164900 1.0 O O26 1 0.77590900 0.39289200 0.16164900 1.0 O O27 1 0.89680300 0.72040200 0.15792200 1.0 O O28 1 0.22040200 0.39680300 0.65792200 1.0 O O29 1 0.77959800 0.60319700 0.65792200 1.0 O O30 1 0.39680300 0.22040200 0.34207800 1.0 O O31 1 0.89289200 0.27590900 0.66164900 1.0 O O32 1 0.10710800 0.72409100 0.66164900 1.0 O O33 1 0.27590900 0.89289200 0.33835100 1.0 O O34 1 0.72409100 0.10710800 0.33835100 1.0 O O35 1 0.24774100 0.03948600 0.62002900 1.0 O O36 1 0.60319700 0.77959800 0.34207800 1.0 O O37 1 0.74774100 0.53948600 0.87997100 1.0 O O38 1 0.46051400 0.25225900 0.12002900 1.0 O O39 1 0.96034800 0.24659700 0.87964300 1.0 O O40 1 0.03965200 0.75340300 0.87964300 1.0 O O41 1 0.24659700 0.96034800 0.12035700 1.0 O O42 1 0.75340300 0.03965200 0.12035700 1.0 O O43 1 0.53948600 0.74774100 0.12002900 1.0 O O44 1 0.71140000 0.71140000 0.50000000 1.0 O O45 1 0.78913200 0.21086800 0.50000000 1.0 O O46 1 0.21086800 0.78913200 0.50000000 1.0 O O47 1 0.28860000 0.28860000 0.50000000 1.0 O O48 1 0.78860000 0.78860000 0.00000000 1.0 O O49 1 0.71086800 0.28913200 0.00000000 1.0 O O50 1 0.28913200 0.71086800 0.00000000 1.0 O O51 1 0.21140000 0.21140000 0.00000000 1.0 O O52 1 0.96051400 0.75225900 0.37997100 1.0 O O53 1 0.74659700 0.46034800 0.37964300 1.0 O O54 1 0.25340300 0.53965200 0.37964300 1.0 O O55 1 0.46034800 0.74659700 0.62035700 1.0 O O56 1 0.53965200 0.25340300 0.62035700 1.0 O O57 1 0.03948600 0.24774100 0.37997100 1.0 O O58 1 0.75225900 0.96051400 0.62002900 1.0 O O59 1 0.25225900 0.46051400 0.87997100 1.0