# generated using pymatgen data_Li2V3(FeO6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.18098900 _cell_length_b 9.24139400 _cell_length_c 12.74388200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2V3(FeO6)2 _chemical_formula_sum 'Li8 V12 Fe8 O48' _cell_volume 1081.25640985 _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 Li Li0 1 0.77316000 0.22141900 0.68920600 1.0 Li Li1 1 0.27316000 0.77858100 0.68920600 1.0 Li Li2 1 0.27316000 0.27858100 0.81079400 1.0 Li Li3 1 0.77316000 0.72141900 0.81079400 1.0 Li Li4 1 0.22684000 0.27858100 0.18920600 1.0 Li Li5 1 0.72684000 0.72141900 0.18920600 1.0 Li Li6 1 0.72684000 0.22141900 0.31079400 1.0 Li Li7 1 0.22684000 0.77858100 0.31079400 1.0 V V8 1 0.75000000 0.46452700 0.50000000 1.0 V V9 1 0.25000000 0.53547300 0.50000000 1.0 V V10 1 0.25000000 0.03547300 0.00000000 1.0 V V11 1 0.75000000 0.96452700 0.00000000 1.0 V V12 1 0.10575400 0.10140700 0.64356300 1.0 V V13 1 0.60575400 0.89859300 0.64356300 1.0 V V14 1 0.60575400 0.39859300 0.85643700 1.0 V V15 1 0.10575400 0.60140700 0.85643700 1.0 V V16 1 0.89424600 0.39859300 0.14356300 1.0 V V17 1 0.39424600 0.60140700 0.14356300 1.0 V V18 1 0.39424600 0.10140700 0.35643700 1.0 V V19 1 0.89424600 0.89859300 0.35643700 1.0 Fe Fe20 1 0.46782500 0.25087000 0.62025400 1.0 Fe Fe21 1 0.96782500 0.74913000 0.62025400 1.0 Fe Fe22 1 0.46782500 0.75087000 0.87974600 1.0 Fe Fe23 1 0.96782500 0.24913000 0.87974600 1.0 Fe Fe24 1 0.53217500 0.24913000 0.12025400 1.0 Fe Fe25 1 0.03217500 0.75087000 0.12025400 1.0 Fe Fe26 1 0.03217500 0.25087000 0.37974600 1.0 Fe Fe27 1 0.53217500 0.74913000 0.37974600 1.0 O O28 1 0.06057100 0.15144700 0.51756600 1.0 O O29 1 0.56057100 0.84855300 0.51756600 1.0 O O30 1 0.87017700 0.57124600 0.56908600 1.0 O O31 1 0.37017700 0.42875400 0.56908600 1.0 O O32 1 0.66118600 0.35048500 0.59063900 1.0 O O33 1 0.16118600 0.64951500 0.59063900 1.0 O O34 1 0.60532300 0.08781200 0.66054700 1.0 O O35 1 0.10532300 0.91218800 0.66054700 1.0 O O36 1 0.27813600 0.16694700 0.67489300 1.0 O O37 1 0.77813600 0.83305300 0.67489300 1.0 O O38 1 0.47622100 0.82383200 0.72833800 1.0 O O39 1 0.97622100 0.17616800 0.72833800 1.0 O O40 1 0.47622100 0.32383200 0.77166200 1.0 O O41 1 0.97622100 0.67616800 0.77166200 1.0 O O42 1 0.27813600 0.66694700 0.82510700 1.0 O O43 1 0.77813600 0.33305300 0.82510700 1.0 O O44 1 0.10532300 0.41218800 0.83945300 1.0 O O45 1 0.60532300 0.58781200 0.83945300 1.0 O O46 1 0.16118600 0.14951500 0.90936100 1.0 O O47 1 0.66118600 0.85048500 0.90936100 1.0 O O48 1 0.87017700 0.07124600 0.93091400 1.0 O O49 1 0.37017700 0.92875400 0.93091400 1.0 O O50 1 0.06057100 0.65144700 0.98243400 1.0 O O51 1 0.56057100 0.34855300 0.98243400 1.0 O O52 1 0.93942900 0.34855300 0.01756600 1.0 O O53 1 0.43942900 0.65144700 0.01756600 1.0 O O54 1 0.62982300 0.07124600 0.06908600 1.0 O O55 1 0.12982300 0.92875400 0.06908600 1.0 O O56 1 0.33881400 0.14951500 0.09063900 1.0 O O57 1 0.83881400 0.85048500 0.09063900 1.0 O O58 1 0.39467700 0.41218800 0.16054700 1.0 O O59 1 0.89467700 0.58781200 0.16054700 1.0 O O60 1 0.72186400 0.33305300 0.17489300 1.0 O O61 1 0.22186400 0.66694700 0.17489300 1.0 O O62 1 0.02377900 0.32383200 0.22833800 1.0 O O63 1 0.52377900 0.67616800 0.22833800 1.0 O O64 1 0.52377900 0.17616800 0.27166200 1.0 O O65 1 0.02377900 0.82383200 0.27166200 1.0 O O66 1 0.22186400 0.16694700 0.32510700 1.0 O O67 1 0.72186400 0.83305300 0.32510700 1.0 O O68 1 0.89467700 0.08781200 0.33945300 1.0 O O69 1 0.39467700 0.91218800 0.33945300 1.0 O O70 1 0.83881400 0.35048500 0.40936100 1.0 O O71 1 0.33881400 0.64951500 0.40936100 1.0 O O72 1 0.12982300 0.42875400 0.43091400 1.0 O O73 1 0.62982300 0.57124600 0.43091400 1.0 O O74 1 0.43942900 0.15144700 0.48243400 1.0 O O75 1 0.93942900 0.84855300 0.48243400 1.0