# generated using pymatgen data_RbW47S96 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 19.14455100 _cell_length_b 22.10622300 _cell_length_c 14.20054100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbW47S96 _chemical_formula_sum 'Rb1 W47 S96' _cell_volume 6009.86369232 _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 -0.000000 0.749474 0.500000 1 W W2 1 0.092553 0.879976 0.500001 1 W W3 1 0.000000 0.493137 0.499995 1 W W4 1 0.083504 0.614804 0.499998 1 W W5 1 0.175906 0.754643 0.500001 1 W W6 1 0.255539 0.878308 0.500003 1 W W7 1 -0.000000 0.247864 0.499999 1 W W8 1 0.083799 0.371279 0.499995 1 W W9 1 0.168077 0.495076 0.499995 1 W W10 1 0.249329 0.625133 0.499999 1 W W11 1 0.337545 0.751374 0.500001 1 W W12 1 0.418453 0.876999 0.500004 1 W W13 1 -0.000000 -0.000706 0.500002 1 W W14 1 0.083666 0.124283 0.500001 1 W W15 1 0.167219 0.248573 0.499999 1 W W16 1 0.250793 0.373089 0.499996 1 W W17 1 0.333368 0.499864 0.499997 1 W W18 1 0.416666 0.625346 0.500000 1 W W19 1 0.500000 0.751082 0.500003 1 W W20 1 0.581547 0.876999 0.500004 1 W W21 1 0.170341 0.003154 0.500003 1 W W22 1 0.251604 0.126222 0.500002 1 W W23 1 0.334106 0.250290 0.500000 1 W W24 1 0.416828 0.375421 0.499998 1 W W25 1 0.500000 0.500339 0.499999 1 W W26 1 0.583334 0.625346 0.500000 1 W W27 1 0.662455 0.751374 0.500002 1 W W28 1 0.744461 0.878308 0.500003 1 W W29 1 0.335625 0.002399 0.500004 1 W W30 1 0.417383 0.126599 0.500002 1 W W31 1 0.500000 0.251091 0.500001 1 W W32 1 0.583172 0.375421 0.499999 1 W W33 1 0.666632 0.499864 0.499998 1 W W34 1 0.750671 0.625133 0.499999 1 W W35 1 0.824094 0.754643 0.500001 1 W W36 1 0.907447 0.879976 0.500001 1 W W37 1 0.500000 0.002067 0.500004 1 W W38 1 0.582617 0.126599 0.500002 1 W W39 1 0.665894 0.250290 0.500001 1 W W40 1 0.749207 0.373089 0.499997 1 W W41 1 0.831923 0.495076 0.499996 1 W W42 1 0.916496 0.614804 0.499998 1 W W43 1 0.664375 0.002399 0.500003 1 W W44 1 0.748396 0.126222 0.500002 1 W W45 1 0.832781 0.248573 0.499999 1 W W46 1 0.916201 0.371279 0.499996 1 W W47 1 0.829659 0.003154 0.500002 1 W W48 1 0.916334 0.124283 0.500001 1 S S49 1 0.102639 0.801511 0.385088 1 S S50 1 0.173474 0.921799 0.388307 1 S S51 1 0.084865 0.533070 0.388487 1 S S52 1 0.164362 0.667539 0.392991 1 S S53 1 0.258037 0.794631 0.388428 1 S S54 1 0.336812 0.919492 0.388338 1 S S55 1 0.083552 0.288907 0.388856 1 S S56 1 0.167457 0.412812 0.388768 1 S S57 1 0.249872 0.541184 0.389635 1 S S58 1 0.333295 0.666900 0.389577 1 S S59 1 0.418811 0.793372 0.388553 1 S S60 1 0.500000 0.918962 0.388521 1 S S61 1 0.083691 0.041315 0.389402 1 S S62 1 0.167099 0.165894 0.389063 1 S S63 1 0.250495 0.290443 0.388911 1 S S64 1 0.333401 0.416556 0.389296 1 S S65 1 0.416609 0.541943 0.389441 1 S S66 1 0.500000 0.667091 0.389428 1 S S67 1 0.581189 0.793372 0.388553 1 S S68 1 0.663188 0.919492 0.388338 1 S S69 1 0.252707 0.044032 0.388531 1 S S70 1 0.334367 0.167761 0.388726 1 S S71 1 0.416909 0.292496 0.389021 1 S S72 1 0.500000 0.417218 0.389207 1 S S73 1 0.583391 0.541943 0.389440 1 S S74 1 0.666705 0.666900 0.389577 1 S S75 1 0.741963 0.794631 0.388428 1 S S76 1 0.826526 0.921799 0.388308 1 S S77 1 0.417754 0.043825 0.388579 1 S S78 1 0.500000 0.168267 0.388812 1 S S79 1 0.583091 0.292496 0.389021 1 S S80 1 0.666599 0.416556 0.389296 1 S S81 1 0.750128 0.541184 0.389634 1 S S82 1 0.835638 0.667539 0.392991 1 S S83 1 0.897360 0.801511 0.385088 1 S S84 1 -0.000000 0.914582 0.392748 1 S S85 1 0.582246 0.043825 0.388579 1 S S86 1 0.665633 0.167761 0.388726 1 S S87 1 0.749504 0.290443 0.388911 1 S S88 1 0.832543 0.412812 0.388767 1 S S89 1 0.915135 0.533071 0.388487 1 S S90 1 0.000000 0.646311 0.385174 1 S S91 1 0.747293 0.044032 0.388531 1 S S92 1 0.832901 0.165894 0.389063 1 S S93 1 0.916448 0.288907 0.388856 1 S S94 1 0.000000 0.411465 0.388536 1 S S95 1 0.916309 0.041315 0.389402 1 S S96 1 -0.000000 0.165148 0.389104 1 S S97 1 0.102640 0.801511 0.614912 1 S S98 1 0.173474 0.921800 0.611690 1 S S99 1 0.084866 0.533070 0.611518 1 S S100 1 0.164362 0.667539 0.607010 1 S S101 1 0.258037 0.794631 0.611569 1 S S102 1 0.336812 0.919492 0.611659 1 S S103 1 0.083552 0.288906 0.611146 1 S S104 1 0.167457 0.412812 0.611238 1 S S105 1 0.249872 0.541184 0.610369 1 S S106 1 0.333295 0.666901 0.610423 1 S S107 1 0.418812 0.793372 0.611444 1 S S108 1 0.500000 0.918962 0.611477 1 S S109 1 0.083691 0.041315 0.610595 1 S S110 1 0.167099 0.165894 0.610935 1 S S111 1 0.250496 0.290442 0.611090 1 S S112 1 0.333402 0.416556 0.610706 1 S S113 1 0.416609 0.541943 0.610559 1 S S114 1 0.500000 0.667091 0.610570 1 S S115 1 0.581188 0.793372 0.611444 1 S S116 1 0.663188 0.919492 0.611659 1 S S117 1 0.252707 0.044032 0.611467 1 S S118 1 0.334367 0.167761 0.611272 1 S S119 1 0.416909 0.292496 0.610979 1 S S120 1 0.500000 0.417218 0.610794 1 S S121 1 0.583391 0.541943 0.610559 1 S S122 1 0.666705 0.666901 0.610422 1 S S123 1 0.741963 0.794631 0.611569 1 S S124 1 0.826526 0.921799 0.611690 1 S S125 1 0.417753 0.043825 0.611419 1 S S126 1 0.500000 0.168267 0.611186 1 S S127 1 0.583091 0.292496 0.610979 1 S S128 1 0.666598 0.416556 0.610705 1 S S129 1 0.750128 0.541184 0.610368 1 S S130 1 0.835638 0.667539 0.607010 1 S S131 1 0.897360 0.801511 0.614912 1 S S132 1 -0.000000 0.914583 0.607251 1 S S133 1 0.582247 0.043825 0.611419 1 S S134 1 0.665633 0.167761 0.611272 1 S S135 1 0.749504 0.290443 0.611090 1 S S136 1 0.832543 0.412812 0.611237 1 S S137 1 0.915134 0.533071 0.611518 1 S S138 1 0.000000 0.646312 0.614827 1 S S139 1 0.747293 0.044032 0.611467 1 S S140 1 0.832901 0.165894 0.610935 1 S S141 1 0.916447 0.288906 0.611146 1 S S142 1 -0.000000 0.411465 0.611470 1 S S143 1 0.916309 0.041315 0.610595 1 S S144 1 -0.000000 0.165148 0.610896 1