# generated using pymatgen data_Li7(Mo3S4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.65767575 _cell_length_b 6.68205940 _cell_length_c 13.36947678 _cell_angle_alpha 95.02086658 _cell_angle_beta 94.24085807 _cell_angle_gamma 95.13205181 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li7(Mo3S4)4 _chemical_formula_sum 'Li7 Mo12 S16' _cell_volume 588.10244498 _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 Li Li0 1 0.05192486 0.09497033 0.43879826 1.0 Li Li1 1 0.38840909 0.95951780 0.00994363 1.0 Li Li2 1 0.56958449 0.01391321 0.49323907 1.0 Li Li3 1 0.91761047 0.13855633 0.97111394 1.0 Li Li4 1 0.97887196 0.61004281 0.51702696 1.0 Li Li5 1 0.97860649 0.01445980 0.70969124 1.0 Li Li6 1 0.97437169 0.01395044 0.19843665 1.0 Mo Mo7 1 0.23690488 0.40936965 0.77467417 1.0 Mo Mo8 1 0.23654692 0.41272453 0.27333914 1.0 Mo Mo9 1 0.45529045 0.76410042 0.79660541 1.0 Mo Mo10 1 0.41339922 0.54162395 0.61898151 1.0 Mo Mo11 1 0.45516205 0.76362073 0.29411732 1.0 Mo Mo12 1 0.41122270 0.54335091 0.11680058 1.0 Mo Mo13 1 0.58922966 0.45655055 0.88487058 1.0 Mo Mo14 1 0.54635536 0.23269701 0.70725543 1.0 Mo Mo15 1 0.58834544 0.45451138 0.38197116 1.0 Mo Mo16 1 0.54573911 0.23565140 0.20457751 1.0 Mo Mo17 1 0.76465126 0.58767326 0.72971894 1.0 Mo Mo18 1 0.76643234 0.58889786 0.22629432 1.0 S S19 1 0.13175830 0.70705426 0.69052120 1.0 S S20 1 0.13389183 0.70720079 0.18864314 1.0 S S21 1 0.28628618 0.61755085 0.93626055 1.0 S S22 1 0.21719319 0.20783838 0.60785061 1.0 S S23 1 0.29124060 0.62429449 0.43622875 1.0 S S24 1 0.21161774 0.21232290 0.10558305 1.0 S S25 1 0.37779816 0.13026806 0.85691832 1.0 S S26 1 0.37360645 0.12815652 0.35514439 1.0 S S27 1 0.62615876 0.86810906 0.64700799 1.0 S S28 1 0.62444430 0.87078046 0.14361439 1.0 S S29 1 0.78331520 0.78845703 0.89382143 1.0 S S30 1 0.71239590 0.37175367 0.56401551 1.0 S S31 1 0.79027794 0.79186507 0.39332315 1.0 S S32 1 0.71592432 0.37789238 0.06584554 1.0 S S33 1 0.87085317 0.28968075 0.81267088 1.0 S S34 1 0.87057953 0.28858795 0.31159528 1.0