# generated using pymatgen data_La7SmTi3V5O20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.01515440 _cell_length_b 11.28151764 _cell_length_c 17.93715876 _cell_angle_alpha 108.28302822 _cell_angle_beta 107.92089883 _cell_angle_gamma 89.92616733 _symmetry_Int_Tables_number 1 _chemical_formula_structural La7SmTi3V5O20 _chemical_formula_sum 'La28 Sm4 Ti12 V20 O80' _cell_volume 2002.57651072 _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 La La0 1 0.30901300 0.05814800 0.12732300 1.0 La La1 1 0.31328400 0.06377600 0.62494000 1.0 La La2 1 0.31374400 0.55916100 0.62913500 1.0 La La3 1 0.81803800 0.06500600 0.62507800 1.0 La La4 1 0.81281600 0.55980900 0.12932400 1.0 La La5 1 0.81765900 0.55962300 0.62927800 1.0 La La6 1 0.19015800 0.43649900 0.37439000 1.0 La La7 1 0.18526700 0.44087700 0.87148100 1.0 La La8 1 0.18090800 0.94201300 0.37120000 1.0 La La9 1 0.18729300 0.93852000 0.87067600 1.0 La La10 1 0.69392100 0.43902200 0.37684200 1.0 La La11 1 0.69214200 0.94048700 0.37460500 1.0 La La12 1 0.68434200 0.94037200 0.87002400 1.0 La La13 1 0.06792300 0.31885900 0.12791000 1.0 La La14 1 0.05935100 0.31354200 0.62459500 1.0 La La15 1 0.06749300 0.81999700 0.63016300 1.0 La La16 1 0.55528900 0.32140600 0.12814900 1.0 La La17 1 0.56285200 0.31812500 0.63028500 1.0 La La18 1 0.56758800 0.81804100 0.12821300 1.0 La La19 1 0.56652900 0.82108500 0.62851700 1.0 La La20 1 0.43670500 0.18676200 0.37637400 1.0 La La21 1 0.43110200 0.18041800 0.87205900 1.0 La La22 1 0.43640000 0.67943800 0.36997200 1.0 La La23 1 0.43905000 0.68198800 0.87143800 1.0 La La24 1 0.93151900 0.17665300 0.37330400 1.0 La La25 1 0.93600400 0.17775900 0.87034500 1.0 La La26 1 0.93812200 0.68450900 0.37206700 1.0 La La27 1 0.93330600 0.67854700 0.86921500 1.0 Sm Sm28 1 0.31147300 0.56211700 0.12617900 1.0 Sm Sm29 1 0.81511900 0.06137200 0.12334200 1.0 Sm Sm30 1 0.68988100 0.43743600 0.87370100 1.0 Sm Sm31 1 0.06081200 0.81504400 0.12476500 1.0 Ti Ti32 1 0.99946100 0.99915300 0.99845700 1.0 Ti Ti33 1 0.00187700 0.50042400 0.00156500 1.0 Ti Ti34 1 0.00268200 0.49827800 0.50123600 1.0 Ti Ti35 1 0.50266900 0.00208400 0.00036000 1.0 Ti Ti36 1 0.49926800 0.00073700 0.49792500 1.0 Ti Ti37 1 0.50273800 0.50002900 0.00127400 1.0 Ti Ti38 1 0.50320700 0.50158700 0.50358000 1.0 Ti Ti39 1 0.25123900 0.74883800 0.99978000 1.0 Ti Ti40 1 0.25086000 0.75116000 0.50035500 1.0 Ti Ti41 1 0.75148500 0.25051500 0.00078400 1.0 Ti Ti42 1 0.75259800 0.74891500 0.99982600 1.0 Ti Ti43 1 0.75241900 0.75152300 0.50122600 1.0 V V44 1 0.00170000 0.99607700 0.49825500 1.0 V V45 1 0.25134000 0.25108500 0.00128200 1.0 V V46 1 0.25200000 0.25055700 0.49913000 1.0 V V47 1 0.74868700 0.25118400 0.49952700 1.0 V V48 1 0.11153700 0.13723300 0.24676900 1.0 V V49 1 0.11814400 0.13838600 0.75064800 1.0 V V50 1 0.12187700 0.64120600 0.24910200 1.0 V V51 1 0.11908600 0.64188500 0.75080400 1.0 V V52 1 0.61507200 0.13675400 0.24697400 1.0 V V53 1 0.62084500 0.14379100 0.75147400 1.0 V V54 1 0.62106800 0.64021400 0.24974600 1.0 V V55 1 0.61907500 0.64392100 0.75115300 1.0 V V56 1 0.37147600 0.36440500 0.25180900 1.0 V V57 1 0.37357500 0.36248100 0.75338400 1.0 V V58 1 0.36235400 0.85752600 0.24872500 1.0 V V59 1 0.37076400 0.85818900 0.75013200 1.0 V V60 1 0.87074600 0.35875800 0.24930000 1.0 V V61 1 0.86513700 0.35925700 0.75337800 1.0 V V62 1 0.86355100 0.85892000 0.24581300 1.0 V V63 1 0.86693200 0.85637700 0.75015600 1.0 O O64 1 0.10728900 0.10895500 0.46442600 1.0 O O65 1 0.11009300 0.10512400 0.97354900 1.0 O O66 1 0.11731300 0.61162400 0.47768800 1.0 O O67 1 0.11502900 0.61233300 0.97736700 1.0 O O68 1 0.60902600 0.10859600 0.47636000 1.0 O O69 1 0.61528800 0.11262700 0.97588800 1.0 O O70 1 0.61563400 0.61313800 0.47752400 1.0 O O71 1 0.61920900 0.61077500 0.97762900 1.0 O O72 1 0.14114800 0.39924600 0.03230300 1.0 O O73 1 0.13586800 0.39249100 0.52373900 1.0 O O74 1 0.13528200 0.88439300 0.02544700 1.0 O O75 1 0.14391300 0.88262400 0.52491100 1.0 O O76 1 0.63756500 0.38607600 0.02475900 1.0 O O77 1 0.63647100 0.39572500 0.52662800 1.0 O O78 1 0.64294900 0.88930600 0.02664700 1.0 O O79 1 0.63788000 0.88704500 0.52159100 1.0 O O80 1 0.36437500 0.10445900 0.47592200 1.0 O O81 1 0.36814300 0.10828100 0.97527300 1.0 O O82 1 0.36597600 0.61597400 0.47524000 1.0 O O83 1 0.36791000 0.61628100 0.97795400 1.0 O O84 1 0.85688400 0.10509600 0.46747400 1.0 O O85 1 0.86350700 0.11318400 0.97776000 1.0 O O86 1 0.86569700 0.61633600 0.47818600 1.0 O O87 1 0.86283000 0.61209700 0.97403500 1.0 O O88 1 0.39155400 0.39916000 0.03044100 1.0 O O89 1 0.39184400 0.39440600 0.52512700 1.0 O O90 1 0.38835700 0.88711100 0.02425400 1.0 O O91 1 0.38933600 0.88235800 0.52271600 1.0 O O92 1 0.88854800 0.38722700 0.02480200 1.0 O O93 1 0.88911800 0.39294800 0.52298800 1.0 O O94 1 0.88996000 0.88734900 0.02738700 1.0 O O95 1 0.88603600 0.88013600 0.52412000 1.0 O O96 1 0.05347400 0.09883000 0.11832400 1.0 O O97 1 0.06527000 0.10524800 0.62425000 1.0 O O98 1 0.05530700 0.60454500 0.12005500 1.0 O O99 1 0.05685300 0.60109900 0.62087300 1.0 O O100 1 0.56811500 0.09793400 0.11947200 1.0 O O101 1 0.55656800 0.09458200 0.62054900 1.0 O O102 1 0.56432700 0.60077600 0.12077100 1.0 O O103 1 0.55732000 0.60289600 0.62187400 1.0 O O104 1 0.43965400 0.40544000 0.38051000 1.0 O O105 1 0.44542400 0.40454900 0.88206800 1.0 O O106 1 0.43644700 0.89715500 0.37828400 1.0 O O107 1 0.44444700 0.90157400 0.88053200 1.0 O O108 1 0.93509300 0.40395800 0.37950600 1.0 O O109 1 0.93711500 0.40203500 0.88252600 1.0 O O110 1 0.94092800 0.89098900 0.37156500 1.0 O O111 1 0.93134100 0.90141900 0.88026200 1.0 O O112 1 0.31671800 0.26493800 0.12669400 1.0 O O113 1 0.32180800 0.27276800 0.62644800 1.0 O O114 1 0.30717100 0.76847000 0.11926300 1.0 O O115 1 0.31096000 0.77011600 0.62031400 1.0 O O116 1 0.81023300 0.26972200 0.11994400 1.0 O O117 1 0.82050200 0.27442900 0.62637900 1.0 O O118 1 0.81557500 0.76932000 0.11872400 1.0 O O119 1 0.80092400 0.77162800 0.62031800 1.0 O O120 1 0.20534100 0.22677600 0.37190700 1.0 O O121 1 0.19611300 0.23547200 0.87591800 1.0 O O122 1 0.18416400 0.72652900 0.37933700 1.0 O O123 1 0.18768200 0.72496000 0.88108200 1.0 O O124 1 0.68468100 0.23061100 0.37278800 1.0 O O125 1 0.69162000 0.23100900 0.88161500 1.0 O O126 1 0.68379100 0.72381200 0.37966000 1.0 O O127 1 0.68550900 0.72953000 0.88128500 1.0 O O128 1 0.45278700 0.03294900 0.25005100 1.0 O O129 1 0.46019400 0.03236500 0.75099000 1.0 O O130 1 0.45507000 0.52771900 0.24103500 1.0 O O131 1 0.46122500 0.53012500 0.75130600 1.0 O O132 1 0.94709700 0.03001000 0.24197600 1.0 O O133 1 0.96148200 0.02592400 0.74969600 1.0 O O134 1 0.96059700 0.52948500 0.24857100 1.0 O O135 1 0.96316000 0.52555000 0.75268400 1.0 O O136 1 0.21104400 0.47035700 0.25065300 1.0 O O137 1 0.20918800 0.46723200 0.74878900 1.0 O O138 1 0.19681200 0.96272100 0.24043200 1.0 O O139 1 0.21470100 0.97436700 0.75292300 1.0 O O140 1 0.70828300 0.46621000 0.24892000 1.0 O O141 1 0.71137100 0.47598500 0.75776800 1.0 O O142 1 0.70543800 0.97066900 0.25004400 1.0 O O143 1 0.71247300 0.97486800 0.75211200 1.0