# generated using pymatgen data_RbSi215 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 16.40618400 _cell_length_b 16.40618400 _cell_length_c 16.40618400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbSi215 _chemical_formula_sum 'Rb1 Si215' _cell_volume 4415.93562766 _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 Rb Rb1 1 0.249999 0.250001 0.083317 1 Si Si2 1 0.250000 0.250000 0.417941 1 Si Si3 1 0.250000 0.250000 0.748712 1 Si Si4 1 0.249999 0.584615 0.083326 1 Si Si5 1 0.250301 0.585185 0.418513 1 Si Si6 1 0.249697 0.585167 0.748161 1 Si Si7 1 0.250001 0.915385 0.083326 1 Si Si8 1 0.249699 0.914815 0.418513 1 Si Si9 1 0.250303 0.914833 0.748161 1 Si Si10 1 0.584615 0.249999 0.083326 1 Si Si11 1 0.585185 0.250301 0.418513 1 Si Si12 1 0.585167 0.249697 0.748161 1 Si Si13 1 0.585177 0.585177 0.083631 1 Si Si14 1 0.583430 0.583430 0.416747 1 Si Si15 1 0.583183 0.583183 0.750147 1 Si Si16 1 0.585174 0.914826 0.083026 1 Si Si17 1 0.583180 0.916820 0.416510 1 Si Si18 1 0.583426 0.916574 0.749893 1 Si Si19 1 0.915385 0.250001 0.083326 1 Si Si20 1 0.914815 0.249699 0.418513 1 Si Si21 1 0.914833 0.250303 0.748161 1 Si Si22 1 0.914826 0.585174 0.083026 1 Si Si23 1 0.916820 0.583180 0.416510 1 Si Si24 1 0.916574 0.583426 0.749893 1 Si Si25 1 0.914823 0.914823 0.083631 1 Si Si26 1 0.916570 0.916570 0.416747 1 Si Si27 1 0.916817 0.916817 0.750147 1 Si Si28 1 0.998039 0.998039 0.000491 1 Si Si29 1 1.000000 1.000000 0.333326 1 Si Si30 1 0.000090 0.000090 0.667023 1 Si Si31 1 0.998359 0.333300 0.000029 1 Si Si32 1 0.998034 0.332840 0.335295 1 Si Si33 1 0.999506 0.333456 0.666226 1 Si Si34 1 0.999504 0.667102 0.999873 1 Si Si35 1 0.000105 0.666305 0.333256 1 Si Si36 1 0.999907 0.666685 0.666639 1 Si Si37 1 0.333300 0.998359 0.000029 1 Si Si38 1 0.332840 0.998034 0.335295 1 Si Si39 1 0.333456 0.999506 0.666226 1 Si Si40 1 0.363149 0.363149 0.970181 1 Si Si41 1 0.333297 0.333297 0.334966 1 Si Si42 1 0.333644 0.333644 0.666195 1 Si Si43 1 0.333645 0.667130 0.999683 1 Si Si44 1 0.333456 0.667102 0.333826 1 Si Si45 1 0.333659 0.667442 0.665905 1 Si Si46 1 0.667102 0.999504 0.999873 1 Si Si47 1 0.666305 0.000105 0.333256 1 Si Si48 1 0.666685 0.999907 0.666639 1 Si Si49 1 0.667130 0.333645 0.999683 1 Si Si50 1 0.667102 0.333456 0.333826 1 Si Si51 1 0.667442 0.333659 0.665905 1 Si Si52 1 0.667488 0.667488 0.999751 1 Si Si53 1 0.666684 0.666684 0.333418 1 Si Si54 1 0.666628 0.666628 0.666698 1 Si Si55 1 0.247489 0.079919 0.253408 1 Si Si56 1 0.250000 0.083011 0.583326 1 Si Si57 1 0.252515 0.079927 0.913254 1 Si Si58 1 0.252511 0.420081 0.253408 1 Si Si59 1 0.250000 0.416989 0.583326 1 Si Si60 1 0.247485 0.420073 0.913254 1 Si Si61 1 0.250000 0.750000 0.250318 1 Si Si62 1 0.250000 0.750000 0.583451 1 Si Si63 1 0.250000 0.750000 0.916338 1 Si Si64 1 0.582937 0.083526 0.249805 1 Si Si65 1 0.583426 0.083021 0.583078 1 Si Si66 1 0.584006 0.082973 0.916302 1 Si Si67 1 0.584006 0.417022 0.250353 1 Si Si68 1 0.583425 0.416988 0.583570 1 Si Si69 1 0.582935 0.416478 0.916853 1 Si Si70 1 0.583405 0.750250 0.250325 1 Si Si71 1 0.583450 0.749997 0.583302 1 Si Si72 1 0.583445 0.749753 0.916363 1 Si Si73 1 0.915994 0.082978 0.250353 1 Si Si74 1 0.916575 0.083012 0.583570 1 Si Si75 1 0.917065 0.083522 0.916853 1 Si Si76 1 0.917063 0.416474 0.249805 1 Si Si77 1 0.916574 0.416979 0.583078 1 Si Si78 1 0.915994 0.417027 0.916302 1 Si Si79 1 0.916595 0.749750 0.250325 1 Si Si80 1 0.916550 0.750003 0.583302 1 Si Si81 1 0.916555 0.750247 0.916363 1 Si Si82 1 0.998360 0.166705 0.166625 1 Si Si83 1 0.999505 0.166546 0.500423 1 Si Si84 1 0.998045 0.167161 0.831373 1 Si Si85 1 0.998040 0.501960 0.166168 1 Si Si86 1 0.000090 0.499910 0.499634 1 Si Si87 1 1.000000 0.500000 0.833326 1 Si Si88 1 0.999507 0.832903 0.166782 1 Si Si89 1 0.999909 0.833318 0.500007 1 Si Si90 1 0.000072 0.833694 0.833432 1 Si Si91 1 0.363144 0.136856 0.196471 1 Si Si92 1 0.333645 0.166355 0.500457 1 Si Si93 1 0.333299 0.166701 0.831687 1 Si Si94 1 0.333295 0.501640 0.166625 1 Si Si95 1 0.333454 0.500495 0.500423 1 Si Si96 1 0.332839 0.501955 0.831373 1 Si Si97 1 0.333643 0.832869 0.166972 1 Si Si98 1 0.333595 0.832519 0.500831 1 Si Si99 1 0.333455 0.832901 0.832835 1 Si Si100 1 0.667131 0.166357 0.166972 1 Si Si101 1 0.667481 0.166405 0.500831 1 Si Si102 1 0.667099 0.166545 0.832835 1 Si Si103 1 0.667097 0.500493 0.166782 1 Si Si104 1 0.666682 0.500091 0.500007 1 Si Si105 1 0.666306 0.499928 0.833432 1 Si Si106 1 0.667435 0.832565 0.167003 1 Si Si107 1 0.666625 0.833375 0.499950 1 Si Si108 1 0.666682 0.833318 0.833237 1 Si Si109 1 0.079919 0.247489 0.253408 1 Si Si110 1 0.083011 0.250000 0.583326 1 Si Si111 1 0.079927 0.252515 0.913254 1 Si Si112 1 0.083526 0.582937 0.249805 1 Si Si113 1 0.083021 0.583426 0.583078 1 Si Si114 1 0.082973 0.584006 0.916302 1 Si Si115 1 0.082978 0.915994 0.250353 1 Si Si116 1 0.083012 0.916575 0.583570 1 Si Si117 1 0.083522 0.917065 0.916853 1 Si Si118 1 0.420081 0.252511 0.253408 1 Si Si119 1 0.416989 0.250000 0.583326 1 Si Si120 1 0.420073 0.247485 0.913254 1 Si Si121 1 0.417022 0.584006 0.250353 1 Si Si122 1 0.416988 0.583425 0.583570 1 Si Si123 1 0.416478 0.582935 0.916853 1 Si Si124 1 0.416474 0.917063 0.249805 1 Si Si125 1 0.416979 0.916574 0.583078 1 Si Si126 1 0.417027 0.915994 0.916302 1 Si Si127 1 0.750000 0.250000 0.250318 1 Si Si128 1 0.750000 0.250000 0.583451 1 Si Si129 1 0.750000 0.250000 0.916338 1 Si Si130 1 0.750250 0.583405 0.250325 1 Si Si131 1 0.749997 0.583450 0.583302 1 Si Si132 1 0.749753 0.583445 0.916363 1 Si Si133 1 0.749750 0.916595 0.250325 1 Si Si134 1 0.750003 0.916550 0.583302 1 Si Si135 1 0.750247 0.916555 0.916363 1 Si Si136 1 0.166705 0.998360 0.166625 1 Si Si137 1 0.166546 0.999505 0.500423 1 Si Si138 1 0.167161 0.998045 0.831373 1 Si Si139 1 0.136855 0.363145 0.196472 1 Si Si140 1 0.166355 0.333645 0.500457 1 Si Si141 1 0.166701 0.333299 0.831687 1 Si Si142 1 0.166357 0.667131 0.166972 1 Si Si143 1 0.166405 0.667481 0.500831 1 Si Si144 1 0.166545 0.667099 0.832835 1 Si Si145 1 0.501960 0.998040 0.166168 1 Si Si146 1 0.499910 0.000090 0.499634 1 Si Si147 1 0.500000 1.000000 0.833326 1 Si Si148 1 0.501640 0.333295 0.166625 1 Si Si149 1 0.500495 0.333454 0.500423 1 Si Si150 1 0.501955 0.332839 0.831373 1 Si Si151 1 0.500493 0.667097 0.166782 1 Si Si152 1 0.500091 0.666682 0.500007 1 Si Si153 1 0.499928 0.666306 0.833432 1 Si Si154 1 0.832903 0.999507 0.166782 1 Si Si155 1 0.833318 0.999909 0.500007 1 Si Si156 1 0.833694 0.000072 0.833432 1 Si Si157 1 0.832869 0.333643 0.166972 1 Si Si158 1 0.832519 0.333595 0.500831 1 Si Si159 1 0.832901 0.333455 0.832835 1 Si Si160 1 0.832565 0.667435 0.167003 1 Si Si161 1 0.833375 0.666625 0.499950 1 Si Si162 1 0.833318 0.666682 0.833237 1 Si Si163 1 0.079922 0.079922 0.085842 1 Si Si164 1 0.082975 0.082975 0.417330 1 Si Si165 1 0.083525 0.083525 0.750392 1 Si Si166 1 0.079923 0.420077 0.080817 1 Si Si167 1 0.083523 0.416477 0.416263 1 Si Si168 1 0.082976 0.417024 0.749321 1 Si Si169 1 0.083011 0.750001 0.083328 1 Si Si170 1 0.083035 0.749751 0.416774 1 Si Si171 1 0.082999 0.750247 0.749919 1 Si Si172 1 0.420077 0.079923 0.080817 1 Si Si173 1 0.416477 0.083523 0.416263 1 Si Si174 1 0.417024 0.082976 0.749321 1 Si Si175 1 0.420078 0.420078 0.085842 1 Si Si176 1 0.417025 0.417025 0.417330 1 Si Si177 1 0.416475 0.416475 0.750392 1 Si Si178 1 0.416989 0.749999 0.083328 1 Si Si179 1 0.416965 0.750249 0.416774 1 Si Si180 1 0.417001 0.749753 0.749919 1 Si Si181 1 0.750001 0.083011 0.083328 1 Si Si182 1 0.749751 0.083035 0.416774 1 Si Si183 1 0.750247 0.082999 0.749919 1 Si Si184 1 0.749999 0.416989 0.083328 1 Si Si185 1 0.750249 0.416965 0.416774 1 Si Si186 1 0.749753 0.417001 0.749919 1 Si Si187 1 0.750000 0.750000 0.083460 1 Si Si188 1 0.750000 0.750000 0.416782 1 Si Si189 1 0.750000 0.750000 0.749877 1 Si Si190 1 0.136851 0.136851 0.970181 1 Si Si191 1 0.166703 0.166703 0.334966 1 Si Si192 1 0.166356 0.166356 0.666195 1 Si Si193 1 0.166700 0.501641 0.000029 1 Si Si194 1 0.167160 0.501966 0.335295 1 Si Si195 1 0.166544 0.500494 0.666226 1 Si Si196 1 0.166355 0.832870 0.999683 1 Si Si197 1 0.166544 0.832898 0.333826 1 Si Si198 1 0.166341 0.832558 0.665905 1 Si Si199 1 0.501641 0.166700 0.000029 1 Si Si200 1 0.501966 0.167160 0.335295 1 Si Si201 1 0.500494 0.166544 0.666226 1 Si Si202 1 0.501961 0.501961 0.000491 1 Si Si203 1 0.500000 0.500000 0.333326 1 Si Si204 1 0.499910 0.499910 0.667023 1 Si Si205 1 0.500496 0.832898 0.999873 1 Si Si206 1 0.499895 0.833695 0.333256 1 Si Si207 1 0.500093 0.833315 0.666639 1 Si Si208 1 0.832870 0.166355 0.999683 1 Si Si209 1 0.832898 0.166544 0.333826 1 Si Si210 1 0.832558 0.166341 0.665905 1 Si Si211 1 0.832898 0.500496 0.999873 1 Si Si212 1 0.833695 0.499895 0.333256 1 Si Si213 1 0.833315 0.500093 0.666639 1 Si Si214 1 0.832512 0.832512 0.999751 1 Si Si215 1 0.833316 0.833316 0.333418 1 Si Si216 1 0.833372 0.833372 0.666698 1