# 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 0.083333 0.791849 0.387710 1 W W2 1 0.002265 0.751099 0.512398 1 W W3 1 0.083333 0.872814 0.512558 1 W W4 1 -0.000096 0.500020 0.500234 1 W W5 1 0.083333 0.624724 0.505763 1 W W6 1 0.164402 0.751099 0.512398 1 W W7 1 0.250274 0.875096 0.505567 1 W W8 1 0.000039 0.249914 0.498137 1 W W9 1 0.083333 0.375051 0.498588 1 W W10 1 0.166763 0.500020 0.500234 1 W W11 1 0.249283 0.625655 0.502060 1 W W12 1 0.332345 0.750193 0.501880 1 W W13 1 0.416724 0.874839 0.499961 1 W W14 1 0.000284 -0.000873 0.502292 1 W W15 1 0.083333 0.124622 0.499501 1 W W16 1 0.166627 0.249914 0.498137 1 W W17 1 0.249987 0.375040 0.497982 1 W W18 1 0.333169 0.500307 0.498399 1 W W19 1 0.416325 0.625216 0.498870 1 W W20 1 0.499773 0.749937 0.498361 1 W W21 1 0.583333 0.874843 0.498293 1 W W22 1 0.166383 -0.000873 0.502293 1 W W23 1 0.249816 0.124750 0.498753 1 W W24 1 0.333258 0.249956 0.497454 1 W W25 1 0.416576 0.375146 0.497171 1 W W26 1 0.499929 0.500185 0.497374 1 W W27 1 0.583333 0.625102 0.497693 1 W W28 1 0.666894 0.749937 0.498361 1 W W29 1 0.749942 0.874839 0.499961 1 W W30 1 0.333284 0.000025 0.500136 1 W W31 1 0.416603 0.124980 0.497868 1 W W32 1 0.499961 0.250064 0.497015 1 W W33 1 0.583333 0.375153 0.496890 1 W W34 1 0.666737 0.500185 0.497375 1 W W35 1 0.750342 0.625216 0.498870 1 W W36 1 0.834321 0.750193 0.501880 1 W W37 1 0.916393 0.875095 0.505567 1 W W38 1 0.499953 -0.000122 0.498403 1 W W39 1 0.583333 0.124960 0.497501 1 W W40 1 0.666706 0.250064 0.497015 1 W W41 1 0.750090 0.375146 0.497171 1 W W42 1 0.833498 0.500307 0.498399 1 W W43 1 0.917384 0.625655 0.502060 1 W W44 1 0.666714 -0.000122 0.498403 1 W W45 1 0.750063 0.124980 0.497868 1 W W46 1 0.833408 0.249956 0.497454 1 W W47 1 0.916680 0.375040 0.497982 1 W W48 1 0.833383 0.000025 0.500136 1 W W49 1 0.916850 0.124750 0.498752 1 S S50 1 0.164738 0.912479 0.395110 1 S S51 1 0.083333 0.542987 0.391424 1 S S52 1 0.163346 0.670156 0.395088 1 S S53 1 0.244729 0.792348 0.394927 1 S S54 1 0.332006 0.915986 0.391209 1 S S55 1 0.083333 0.291779 0.387502 1 S S56 1 0.166471 0.417312 0.388084 1 S S57 1 0.249065 0.543094 0.389455 1 S S58 1 0.331727 0.667437 0.390114 1 S S59 1 0.414939 0.791556 0.389238 1 S S60 1 0.499482 0.916309 0.387988 1 S S61 1 0.083333 0.040153 0.390572 1 S S62 1 0.166345 0.166079 0.388013 1 S S63 1 0.249721 0.291679 0.387032 1 S S64 1 0.332908 0.417183 0.387052 1 S S65 1 0.416102 0.542239 0.387376 1 S S66 1 0.499412 0.666802 0.387418 1 S S67 1 0.583333 0.791511 0.387490 1 S S68 1 0.667184 0.916309 0.387988 1 S S69 1 0.248956 0.040330 0.389643 1 S S70 1 0.332858 0.166205 0.387221 1 S S71 1 0.416414 0.291698 0.386415 1 S S72 1 0.499825 0.416937 0.386341 1 S S73 1 0.583333 0.541956 0.386634 1 S S74 1 0.667254 0.666802 0.387418 1 S S75 1 0.751728 0.791556 0.389238 1 S S76 1 0.834661 0.915986 0.391209 1 S S77 1 0.416082 0.041171 0.387962 1 S S78 1 0.499843 0.166426 0.386668 1 S S79 1 0.583333 0.291703 0.386197 1 S S80 1 0.666841 0.416937 0.386341 1 S S81 1 0.750565 0.542239 0.387376 1 S S82 1 0.834940 0.667437 0.390114 1 S S83 1 0.921938 0.792348 0.394927 1 S S84 1 0.001929 0.912479 0.395110 1 S S85 1 0.583333 0.041243 0.387329 1 S S86 1 0.666823 0.166426 0.386668 1 S S87 1 0.750253 0.291699 0.386415 1 S S88 1 0.833758 0.417183 0.387052 1 S S89 1 0.917601 0.543094 0.389456 1 S S90 1 0.003320 0.670156 0.395088 1 S S91 1 0.750584 0.041171 0.387962 1 S S92 1 0.833808 0.166205 0.387221 1 S S93 1 0.916946 0.291679 0.387032 1 S S94 1 0.000196 0.417312 0.388084 1 S S95 1 0.917711 0.040330 0.389643 1 S S96 1 0.000321 0.166079 0.388013 1 S S97 1 0.083333 0.791631 0.627684 1 S S98 1 0.169002 0.917872 0.617514 1 S S99 1 0.083333 0.539577 0.612647 1 S S100 1 0.166859 0.664337 0.617490 1 S S101 1 0.252466 0.792671 0.617302 1 S S102 1 0.335450 0.917615 0.612403 1 S S103 1 0.083333 0.291515 0.608968 1 S S104 1 0.166963 0.415996 0.609688 1 S S105 1 0.250617 0.541212 0.610786 1 S S106 1 0.333848 0.666457 0.611414 1 S S107 1 0.417443 0.791395 0.610558 1 S S108 1 0.500633 0.916730 0.609595 1 S S109 1 0.083333 0.042035 0.611868 1 S S110 1 0.166792 0.166872 0.609500 1 S S111 1 0.250206 0.291588 0.608546 1 S S112 1 0.333556 0.416577 0.608512 1 S S113 1 0.416943 0.541532 0.608909 1 S S114 1 0.500253 0.666579 0.608969 1 S S115 1 0.583333 0.791490 0.608903 1 S S116 1 0.666033 0.916730 0.609595 1 S S117 1 0.250283 0.042256 0.610944 1 S S118 1 0.333493 0.166874 0.608678 1 S S119 1 0.416758 0.291767 0.607880 1 S S120 1 0.500062 0.416687 0.607829 1 S S121 1 0.583333 0.541653 0.608170 1 S S122 1 0.666414 0.666579 0.608969 1 S S123 1 0.749224 0.791396 0.610557 1 S S124 1 0.831217 0.917616 0.612402 1 S S125 1 0.417232 0.042192 0.609520 1 S S126 1 0.500108 0.166931 0.608145 1 S S127 1 0.583333 0.291815 0.607644 1 S S128 1 0.666605 0.416687 0.607829 1 S S129 1 0.749724 0.541532 0.608909 1 S S130 1 0.832819 0.666457 0.611414 1 S S131 1 0.914200 0.792671 0.617302 1 S S132 1 -0.002336 0.917872 0.617513 1 S S133 1 0.583333 0.041873 0.608763 1 S S134 1 0.666559 0.166931 0.608145 1 S S135 1 0.749909 0.291767 0.607880 1 S S136 1 0.833111 0.416577 0.608512 1 S S137 1 0.916050 0.541212 0.610786 1 S S138 1 -0.000192 0.664337 0.617490 1 S S139 1 0.749435 0.042192 0.609520 1 S S140 1 0.833174 0.166874 0.608678 1 S S141 1 0.916461 0.291588 0.608546 1 S S142 1 -0.000297 0.415996 0.609688 1 S S143 1 0.916384 0.042256 0.610944 1 S S144 1 -0.000126 0.166872 0.609500 1