# generated using pymatgen data_VW48S95 _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 VW48S95 _chemical_formula_sum 'V1 W48 S95' _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 V V1 1 0.083334 0.791916 0.388172 1 W W2 1 0.002181 0.751050 0.512396 1 W W3 1 0.083333 0.872904 0.512582 1 W W4 1 -0.000113 0.499999 0.500250 1 W W5 1 0.083333 0.624651 0.505777 1 W W6 1 0.164486 0.751050 0.512397 1 W W7 1 0.250333 0.875130 0.505571 1 W W8 1 0.000038 0.249939 0.498150 1 W W9 1 0.083333 0.375045 0.498607 1 W W10 1 0.166779 0.499999 0.500250 1 W W11 1 0.249285 0.625623 0.502077 1 W W12 1 0.332351 0.750183 0.501880 1 W W13 1 0.416741 0.874835 0.499940 1 W W14 1 0.000267 -0.000843 0.502293 1 W W15 1 0.083333 0.124677 0.499507 1 W W16 1 0.166629 0.249939 0.498151 1 W W17 1 0.250003 0.375038 0.497992 1 W W18 1 0.333176 0.500260 0.498432 1 W W19 1 0.416349 0.625169 0.498894 1 W W20 1 0.499783 0.749910 0.498389 1 W W21 1 0.583333 0.874839 0.498288 1 W W22 1 0.166400 -0.000843 0.502293 1 W W23 1 0.249842 0.124792 0.498757 1 W W24 1 0.333273 0.249974 0.497445 1 W W25 1 0.416595 0.375131 0.497174 1 W W26 1 0.499934 0.500145 0.497400 1 W W27 1 0.583333 0.625046 0.497733 1 W W28 1 0.666883 0.749910 0.498389 1 W W29 1 0.749926 0.874835 0.499940 1 W W30 1 0.333295 0.000058 0.500109 1 W W31 1 0.416617 0.125020 0.497844 1 W W32 1 0.499978 0.250080 0.496991 1 W W33 1 0.583333 0.375119 0.496882 1 W W34 1 0.666733 0.500144 0.497399 1 W W35 1 0.750318 0.625169 0.498893 1 W W36 1 0.834315 0.750182 0.501879 1 W W37 1 0.916334 0.875129 0.505570 1 W W38 1 0.499963 -0.000091 0.498379 1 W W39 1 0.583333 0.124993 0.497469 1 W W40 1 0.666688 0.250080 0.496990 1 W W41 1 0.750072 0.375131 0.497173 1 W W42 1 0.833490 0.500260 0.498432 1 W W43 1 0.917382 0.625623 0.502077 1 W W44 1 0.666703 -0.000091 0.498379 1 W W45 1 0.750050 0.125020 0.497843 1 W W46 1 0.833394 0.249974 0.497445 1 W W47 1 0.916663 0.375038 0.497992 1 W W48 1 0.833373 0.000058 0.500109 1 W W49 1 0.916825 0.124792 0.498758 1 S S50 1 0.164748 0.912519 0.395155 1 S S51 1 0.083333 0.542932 0.391455 1 S S52 1 0.163368 0.670111 0.395130 1 S S53 1 0.244757 0.792345 0.394947 1 S S54 1 0.332041 0.916015 0.391205 1 S S55 1 0.083334 0.291791 0.387512 1 S S56 1 0.166483 0.417299 0.388113 1 S S57 1 0.249093 0.543056 0.389495 1 S S58 1 0.331746 0.667400 0.390164 1 S S59 1 0.414957 0.791524 0.389269 1 S S60 1 0.499494 0.916320 0.388007 1 S S61 1 0.083333 0.040205 0.390620 1 S S62 1 0.166354 0.166116 0.388026 1 S S63 1 0.249736 0.291686 0.387036 1 S S64 1 0.332932 0.417162 0.387069 1 S S65 1 0.416115 0.542188 0.387426 1 S S66 1 0.499427 0.666762 0.387475 1 S S67 1 0.583333 0.791488 0.387539 1 S S68 1 0.667173 0.916320 0.388007 1 S S69 1 0.248961 0.040380 0.389658 1 S S70 1 0.332872 0.166245 0.387222 1 S S71 1 0.416428 0.291708 0.386404 1 S S72 1 0.499834 0.416912 0.386344 1 S S73 1 0.583333 0.541906 0.386672 1 S S74 1 0.667239 0.666762 0.387474 1 S S75 1 0.751709 0.791524 0.389268 1 S S76 1 0.834626 0.916015 0.391205 1 S S77 1 0.416093 0.041215 0.387965 1 S S78 1 0.499851 0.166461 0.386639 1 S S79 1 0.583333 0.291709 0.386148 1 S S80 1 0.666833 0.416912 0.386344 1 S S81 1 0.750552 0.542188 0.387426 1 S S82 1 0.834920 0.667400 0.390163 1 S S83 1 0.921910 0.792345 0.394947 1 S S84 1 0.001919 0.912520 0.395155 1 S S85 1 0.583333 0.041279 0.387317 1 S S86 1 0.666816 0.166461 0.386639 1 S S87 1 0.750239 0.291708 0.386405 1 S S88 1 0.833735 0.417162 0.387070 1 S S89 1 0.917574 0.543056 0.389495 1 S S90 1 0.003299 0.670111 0.395130 1 S S91 1 0.750574 0.041214 0.387964 1 S S92 1 0.833795 0.166245 0.387222 1 S S93 1 0.916931 0.291687 0.387036 1 S S94 1 0.000183 0.417299 0.388114 1 S S95 1 0.917706 0.040380 0.389658 1 S S96 1 0.000312 0.166116 0.388027 1 S S97 1 0.083333 0.791634 0.627581 1 S S98 1 0.169093 0.917914 0.617501 1 S S99 1 0.083333 0.539522 0.612640 1 S S100 1 0.166846 0.664276 0.617456 1 S S101 1 0.252507 0.792703 0.617258 1 S S102 1 0.335502 0.917649 0.612344 1 S S103 1 0.083333 0.291527 0.608953 1 S S104 1 0.166976 0.415973 0.609663 1 S S105 1 0.250635 0.541172 0.610774 1 S S106 1 0.333867 0.666431 0.611357 1 S S107 1 0.417456 0.791395 0.610505 1 S S108 1 0.500634 0.916754 0.609520 1 S S109 1 0.083333 0.042089 0.611808 1 S S110 1 0.166807 0.166916 0.609472 1 S S111 1 0.250225 0.291594 0.608523 1 S S112 1 0.333583 0.416534 0.608518 1 S S113 1 0.416955 0.541481 0.608910 1 S S114 1 0.500261 0.666541 0.608956 1 S S115 1 0.583333 0.791478 0.608878 1 S S116 1 0.666033 0.916754 0.609520 1 S S117 1 0.250315 0.042303 0.610898 1 S S118 1 0.333519 0.166916 0.608658 1 S S119 1 0.416783 0.291764 0.607861 1 S S120 1 0.500083 0.416640 0.607827 1 S S121 1 0.583334 0.541594 0.608173 1 S S122 1 0.666406 0.666541 0.608955 1 S S123 1 0.749210 0.791394 0.610503 1 S S124 1 0.831167 0.917648 0.612344 1 S S125 1 0.417251 0.042239 0.609461 1 S S126 1 0.500128 0.166969 0.608102 1 S S127 1 0.583333 0.291807 0.607632 1 S S128 1 0.666584 0.416640 0.607827 1 S S129 1 0.749712 0.541481 0.608909 1 S S130 1 0.832799 0.666431 0.611357 1 S S131 1 0.914159 0.792703 0.617257 1 S S132 1 -0.002426 0.917914 0.617501 1 S S133 1 0.583333 0.041911 0.608708 1 S S134 1 0.666539 0.166969 0.608102 1 S S135 1 0.749884 0.291764 0.607861 1 S S136 1 0.833083 0.416534 0.608519 1 S S137 1 0.916032 0.541172 0.610774 1 S S138 1 -0.000179 0.664276 0.617456 1 S S139 1 0.749416 0.042239 0.609460 1 S S140 1 0.833147 0.166916 0.608659 1 S S141 1 0.916442 0.291593 0.608523 1 S S142 1 -0.000309 0.415973 0.609663 1 S S143 1 0.916352 0.042303 0.610899 1 S S144 1 -0.000140 0.166916 0.609472 1