# generated using pymatgen data_Li7Si3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.52741895 _cell_length_b 7.52781684 _cell_length_c 17.84231328 _cell_angle_alpha 90.02470226 _cell_angle_beta 89.98347694 _cell_angle_gamma 120.00195093 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li7Si3 _chemical_formula_sum 'Li42 Si18' _cell_volume 875.56490129 _cell_formula_units_Z 6 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 Li Li0 1 0.55577956 0.44428856 0.66657742 1.0 Li Li1 1 0.88912704 0.44462914 -0.00000248 1.0 Li Li2 1 0.55586147 0.11160119 0.33343253 1.0 Li Li3 1 0.22396388 0.77605357 0.66672750 1.0 Li Li4 1 0.55320274 0.77651654 0.00008706 1.0 Li Li5 1 0.22399122 0.44797212 0.33327860 1.0 Li Li6 1 0.21997346 0.10896625 0.13476295 1.0 Li Li7 1 0.88915849 0.78002741 0.46835441 1.0 Li Li8 1 0.89085421 0.11058083 0.80172225 1.0 Li Li9 1 0.88909410 0.10905087 0.53167861 1.0 Li Li10 1 0.89088475 0.78020034 0.19826364 1.0 Li Li11 1 0.21992067 0.11100145 0.86524859 1.0 Li Li12 1 0.20004545 0.09044219 0.28856211 1.0 Li Li13 1 0.89004129 0.80012962 0.62223441 1.0 Li Li14 1 0.90955928 0.10988319 0.95567234 1.0 Li Li15 1 0.89003578 0.08994011 0.37777152 1.0 Li Li16 1 0.91000128 0.80008656 0.04431312 1.0 Li Li17 1 0.20004331 0.10947782 0.71143553 1.0 Li Li18 1 0.55321073 0.44228845 0.81709041 1.0 Li Li19 1 0.88864459 0.44732883 0.15028620 1.0 Li Li20 1 0.55848237 0.11132148 0.48389018 1.0 Li Li21 1 0.88884433 0.44142838 0.84980158 1.0 Li Li22 1 0.55848518 0.44713983 0.51608485 1.0 Li Li23 1 0.55317639 0.11095288 0.18295101 1.0 Li Li24 1 0.53187325 0.42063110 0.95992323 1.0 Li Li25 1 0.88843567 0.46848569 0.29354122 1.0 Li Li26 1 0.57884769 0.11023082 0.62642333 1.0 Li Li27 1 0.88870967 0.41958479 0.70663032 1.0 Li Li28 1 0.57898398 0.46866998 0.37353949 1.0 Li Li29 1 0.53191024 0.11127662 0.04008693 1.0 Li Li30 1 0.21941408 0.44081282 0.48404080 1.0 Li Li31 1 0.22046872 0.78059441 0.81732507 1.0 Li Li32 1 0.55912484 0.77869683 0.15042839 1.0 Li Li33 1 0.22056132 0.43989945 0.18264714 1.0 Li Li34 1 0.55911182 0.78040870 0.84958342 1.0 Li Li35 1 0.21954117 0.77885850 0.51599421 1.0 Li Li36 1 0.19816331 0.41895153 0.62709956 1.0 Li Li37 1 0.22084223 0.80246303 0.96001729 1.0 Li Li38 1 0.58101899 0.77885457 0.29354307 1.0 Li Li39 1 0.22046776 0.41814812 0.03989134 1.0 Li Li40 1 0.58106086 0.80218158 0.70645619 1.0 Li Li41 1 0.19824072 0.77942835 0.37277255 1.0 Si Si42 1 0.24024028 0.12399043 0.43426392 1.0 Si Si43 1 0.88378689 0.75989186 0.76758149 1.0 Si Si44 1 0.87610240 0.11609235 0.10100237 1.0 Si Si45 1 0.88379028 0.12386334 0.23241925 1.0 Si Si46 1 0.87613852 0.76004617 0.89899904 1.0 Si Si47 1 0.24022709 0.11630836 0.56573423 1.0 Si Si48 1 0.56400241 0.45345426 0.10150344 1.0 Si Si49 1 0.88955069 0.43611831 0.43486405 1.0 Si Si50 1 0.54669483 0.11050964 0.76813637 1.0 Si Si51 1 0.88953888 0.45345235 0.56519098 1.0 Si Si52 1 0.54673967 0.43619913 0.23185912 1.0 Si Si53 1 0.56399849 0.11060196 0.89848601 1.0 Si Si54 1 0.23512348 0.46215337 0.76809694 1.0 Si Si55 1 0.22702885 0.76485695 0.10134265 1.0 Si Si56 1 0.53790394 0.77314142 0.43471433 1.0 Si Si57 1 0.22701302 0.46215034 0.89865304 1.0 Si Si58 1 0.53789323 0.76477382 0.56528181 1.0 Si Si59 1 0.23507218 0.77290948 0.23189504 1.0