# generated using pymatgen data_Rb3Mo4(P2O11)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.27674700 _cell_length_b 10.27674700 _cell_length_c 19.55035600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb3Mo4(P2O11)2 _chemical_formula_sum 'Rb12 Mo16 P16 O88' _cell_volume 2064.74298774 _cell_formula_units_Z 4 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 Rb0 1 0.11300100 0.00779200 0.12306800 1.0 Rb Rb1 1 0.88699900 0.99220800 0.62306800 1.0 Rb Rb2 1 0.50779200 0.38699900 0.37306800 1.0 Rb Rb3 1 0.49220800 0.61300100 0.87306800 1.0 Rb Rb4 1 0.99220800 0.88699900 0.37693200 1.0 Rb Rb5 1 0.00779200 0.11300100 0.87693200 1.0 Rb Rb6 1 0.38699900 0.50779200 0.62693200 1.0 Rb Rb7 1 0.61300100 0.49220800 0.12693200 1.0 Rb Rb8 1 0.79186400 0.79186400 0.00000000 1.0 Rb Rb9 1 0.20813600 0.20813600 0.50000000 1.0 Rb Rb10 1 0.29186400 0.70813600 0.25000000 1.0 Rb Rb11 1 0.70813600 0.29186400 0.75000000 1.0 Mo Mo12 1 0.48288600 0.13583800 0.18876700 1.0 Mo Mo13 1 0.51711400 0.86416200 0.68876700 1.0 Mo Mo14 1 0.63583800 0.01711400 0.43876700 1.0 Mo Mo15 1 0.36416200 0.98288600 0.93876700 1.0 Mo Mo16 1 0.86416200 0.51711400 0.31123300 1.0 Mo Mo17 1 0.13583800 0.48288600 0.81123300 1.0 Mo Mo18 1 0.01711400 0.63583800 0.56123300 1.0 Mo Mo19 1 0.98288600 0.36416200 0.06123300 1.0 Mo Mo20 1 0.74441800 0.89405000 0.18533900 1.0 Mo Mo21 1 0.25558200 0.10595000 0.68533900 1.0 Mo Mo22 1 0.39405000 0.75558200 0.43533900 1.0 Mo Mo23 1 0.60595000 0.24441800 0.93533900 1.0 Mo Mo24 1 0.10595000 0.25558200 0.31466100 1.0 Mo Mo25 1 0.89405000 0.74441800 0.81466100 1.0 Mo Mo26 1 0.75558200 0.39405000 0.56466100 1.0 Mo Mo27 1 0.24441800 0.60595000 0.06466100 1.0 P P28 1 0.73763200 0.15578400 0.08027600 1.0 P P29 1 0.26236800 0.84421600 0.58027600 1.0 P P30 1 0.65578400 0.76236800 0.33027600 1.0 P P31 1 0.34421600 0.23763200 0.83027600 1.0 P P32 1 0.84421600 0.26236800 0.41972400 1.0 P P33 1 0.15578400 0.73763200 0.91972400 1.0 P P34 1 0.76236800 0.65578400 0.66972400 1.0 P P35 1 0.23763200 0.34421600 0.16972400 1.0 P P36 1 0.45456400 0.85586600 0.08999800 1.0 P P37 1 0.54543600 0.14413400 0.58999800 1.0 P P38 1 0.35586600 0.04543600 0.33999800 1.0 P P39 1 0.64413400 0.95456400 0.83999800 1.0 P P40 1 0.14413400 0.54543600 0.41000200 1.0 P P41 1 0.85586600 0.45456400 0.91000200 1.0 P P42 1 0.04543600 0.35586600 0.66000200 1.0 P P43 1 0.95456400 0.64413400 0.16000200 1.0 O O44 1 0.52229200 0.27194000 0.23643000 1.0 O O45 1 0.47770800 0.72806000 0.73643000 1.0 O O46 1 0.77194000 0.97770800 0.48643000 1.0 O O47 1 0.22806000 0.02229200 0.98643000 1.0 O O48 1 0.72806000 0.47770800 0.26357000 1.0 O O49 1 0.27194000 0.52229200 0.76357000 1.0 O O50 1 0.97770800 0.77194000 0.51357000 1.0 O O51 1 0.02229200 0.22806000 0.01357000 1.0 O O52 1 0.61685600 0.01886700 0.21374100 1.0 O O53 1 0.38314400 0.98113300 0.71374100 1.0 O O54 1 0.51886700 0.88314400 0.46374100 1.0 O O55 1 0.48113300 0.11685600 0.96374100 1.0 O O56 1 0.98113300 0.38314400 0.28625900 1.0 O O57 1 0.01886700 0.61685600 0.78625900 1.0 O O58 1 0.88314400 0.51886700 0.53625900 1.0 O O59 1 0.11685600 0.48113300 0.03625900 1.0 O O60 1 0.59814300 0.18394300 0.10647700 1.0 O O61 1 0.40185700 0.81605700 0.60647700 1.0 O O62 1 0.68394300 0.90185700 0.35647700 1.0 O O63 1 0.31605700 0.09814300 0.85647700 1.0 O O64 1 0.81605700 0.40185700 0.39352300 1.0 O O65 1 0.18394300 0.59814300 0.89352300 1.0 O O66 1 0.90185700 0.68394300 0.64352300 1.0 O O67 1 0.09814300 0.31605700 0.14352300 1.0 O O68 1 0.36303800 0.04925600 0.25999000 1.0 O O69 1 0.63696200 0.95074400 0.75999000 1.0 O O70 1 0.54925600 0.13696200 0.50999000 1.0 O O71 1 0.45074400 0.86303800 0.00999000 1.0 O O72 1 0.95074400 0.63696200 0.24001000 1.0 O O73 1 0.04925600 0.36303800 0.74001000 1.0 O O74 1 0.13696200 0.54925600 0.49001000 1.0 O O75 1 0.86303800 0.45074400 0.99001000 1.0 O O76 1 0.32657700 0.23348000 0.14289600 1.0 O O77 1 0.67342300 0.76652000 0.64289600 1.0 O O78 1 0.73348000 0.17342300 0.39289600 1.0 O O79 1 0.26652000 0.82657700 0.89289600 1.0 O O80 1 0.76652000 0.67342300 0.35710400 1.0 O O81 1 0.23348000 0.32657700 0.85710400 1.0 O O82 1 0.17342300 0.73348000 0.60710400 1.0 O O83 1 0.82657700 0.26652000 0.10710400 1.0 O O84 1 0.40874700 0.98368700 0.12303200 1.0 O O85 1 0.59125300 0.01631300 0.62303200 1.0 O O86 1 0.48368700 0.09125300 0.37303200 1.0 O O87 1 0.51631300 0.90874700 0.87303200 1.0 O O88 1 0.01631300 0.59125300 0.37696800 1.0 O O89 1 0.98368700 0.40874700 0.87696800 1.0 O O90 1 0.09125300 0.48368700 0.62696800 1.0 O O91 1 0.90874700 0.51631300 0.12696800 1.0 O O92 1 0.87422900 0.93344700 0.23675200 1.0 O O93 1 0.12577100 0.06655300 0.73675200 1.0 O O94 1 0.43344700 0.62577100 0.48675200 1.0 O O95 1 0.56655300 0.37422900 0.98675200 1.0 O O96 1 0.06655300 0.12577100 0.26324800 1.0 O O97 1 0.93344700 0.87422900 0.76324800 1.0 O O98 1 0.62577100 0.43344700 0.51324800 1.0 O O99 1 0.37422900 0.56655300 0.01324800 1.0 O O100 1 0.65607800 0.76287800 0.25059300 1.0 O O101 1 0.34392200 0.23712200 0.75059300 1.0 O O102 1 0.26287800 0.84392200 0.50059300 1.0 O O103 1 0.73712200 0.15607800 0.00059300 1.0 O O104 1 0.23712200 0.34392200 0.24940700 1.0 O O105 1 0.76287800 0.65607800 0.74940700 1.0 O O106 1 0.84392200 0.26287800 0.49940700 1.0 O O107 1 0.15607800 0.73712200 0.99940700 1.0 O O108 1 0.85545400 0.75121400 0.13620100 1.0 O O109 1 0.14454600 0.24878600 0.63620100 1.0 O O110 1 0.25121400 0.64454600 0.38620100 1.0 O O111 1 0.74878600 0.35545400 0.88620100 1.0 O O112 1 0.24878600 0.14454600 0.36379900 1.0 O O113 1 0.75121400 0.85545400 0.86379900 1.0 O O114 1 0.64454600 0.25121400 0.61379900 1.0 O O115 1 0.35545400 0.74878600 0.11379900 1.0 O O116 1 0.79023400 0.01978200 0.10316400 1.0 O O117 1 0.20976600 0.98021800 0.60316400 1.0 O O118 1 0.51978200 0.70976600 0.35316400 1.0 O O119 1 0.48021800 0.29023400 0.85316400 1.0 O O120 1 0.98021800 0.20976600 0.39683600 1.0 O O121 1 0.01978200 0.79023400 0.89683600 1.0 O O122 1 0.70976600 0.51978200 0.64683600 1.0 O O123 1 0.29023400 0.48021800 0.14683600 1.0 O O124 1 0.59363400 0.81588600 0.11196000 1.0 O O125 1 0.40636600 0.18411400 0.61196000 1.0 O O126 1 0.31588600 0.90636600 0.36196000 1.0 O O127 1 0.68411400 0.09363400 0.86196000 1.0 O O128 1 0.18411400 0.40636600 0.38804000 1.0 O O129 1 0.81588600 0.59363400 0.88804000 1.0 O O130 1 0.90636600 0.31588600 0.63804000 1.0 O O131 1 0.09363400 0.68411400 0.13804000 1.0