# generated using pymatgen data_Li2MnVP2(O4F)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.31218300 _cell_length_b 7.57746671 _cell_length_c 10.52811370 _cell_angle_alpha 105.08366315 _cell_angle_beta 97.28915498 _cell_angle_gamma 109.73885186 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2MnVP2(O4F)2 _chemical_formula_sum 'Li4 Mn2 V2 P4 O16 F4' _cell_volume 374.23466130 _cell_formula_units_Z 2 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 0.53745900 0.62095800 0.80976500 1.0 Li Li1 1 0.03434200 0.11691700 0.30684500 1.0 Li Li2 1 0.96565800 0.88308300 0.69315500 1.0 Li Li3 1 0.46254100 0.37904200 0.19023500 1.0 Mn Mn4 1 0.00000000 0.00000000 0.00000000 1.0 Mn Mn5 1 0.50000000 0.00000000 0.50000000 1.0 V V6 1 0.50000000 0.50000000 0.50000000 1.0 V V7 1 0.00000000 0.50000000 0.00000000 1.0 P P8 1 0.50201800 0.05293400 0.82092700 1.0 P P9 1 0.00330600 0.55899100 0.32161700 1.0 P P10 1 0.99669400 0.44100900 0.67838300 1.0 P P11 1 0.49798200 0.94706600 0.17907300 1.0 O O12 1 0.70067400 0.94435900 0.83089500 1.0 O O13 1 0.20340000 0.45047000 0.33176800 1.0 O O14 1 0.65654400 0.28077800 0.89730000 1.0 O O15 1 0.36832900 0.01308300 0.67083300 1.0 O O16 1 0.14210400 0.78215000 0.39284400 1.0 O O17 1 0.87480700 0.51253500 0.16635800 1.0 O O18 1 0.24907500 0.96719800 0.87536300 1.0 O O19 1 0.74490400 0.46537400 0.37243100 1.0 O O20 1 0.25509600 0.53462600 0.62756900 1.0 O O21 1 0.75092500 0.03280200 0.12463700 1.0 O O22 1 0.12519300 0.48746500 0.83364200 1.0 O O23 1 0.85789600 0.21785000 0.60715600 1.0 O O24 1 0.63167100 0.98691700 0.32916700 1.0 O O25 1 0.34345600 0.71922200 0.10270000 1.0 O O26 1 0.79660000 0.54953000 0.66823200 1.0 O O27 1 0.29932600 0.05564100 0.16910500 1.0 F F28 1 0.83254600 0.67759200 0.96300000 1.0 F F29 1 0.33199700 0.21218300 0.46179100 1.0 F F30 1 0.66800300 0.78781700 0.53820900 1.0 F F31 1 0.16745400 0.32240800 0.03700000 1.0