# generated using pymatgen
data_Li2MnF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.33047200
_cell_length_b   8.85617800
_cell_length_c   17.76028430
_cell_angle_alpha   61.13215202
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MnF4
_chemical_formula_sum   'Li24 Mn12 F48'
_cell_volume   1009.72053335
_cell_formula_units_Z   12
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  0.65270400  0.15792000  0.90880000  1
  Li  Li1  1  0.25091900  0.15617600  0.90888200  1
  Li  Li2  1  0.80683300  0.82297600  0.25376500  1
  Li  Li3  1  0.25246700  0.81241100  0.26466000  1
  Li  Li4  1  0.67614300  0.51813000  0.57914400  1
  Li  Li5  1  0.25733400  0.53396700  0.57977600  1
  Li  Li6  1  0.75733400  0.46603300  0.92022400  1
  Li  Li7  1  0.17614300  0.48187000  0.92085600  1
  Li  Li8  1  0.75246700  0.18758900  0.23534000  1
  Li  Li9  1  0.30683300  0.17702400  0.24623500  1
  Li  Li10  1  0.75091900  0.84382400  0.59111800  1
  Li  Li11  1  0.15270400  0.84208000  0.59120000  1
  Li  Li12  1  0.84729600  0.15792000  0.40880000  1
  Li  Li13  1  0.24908100  0.15617600  0.40888200  1
  Li  Li14  1  0.69316700  0.82297600  0.75376500  1
  Li  Li15  1  0.24753300  0.81241100  0.76466000  1
  Li  Li16  1  0.82385700  0.51813000  0.07914400  1
  Li  Li17  1  0.24266600  0.53396700  0.07977600  1
  Li  Li18  1  0.74266600  0.46603300  0.42022400  1
  Li  Li19  1  0.32385700  0.48187000  0.42085600  1
  Li  Li20  1  0.74753300  0.18758900  0.73534000  1
  Li  Li21  1  0.19316700  0.17702400  0.74623500  1
  Li  Li22  1  0.74908100  0.84382400  0.09111800  1
  Li  Li23  1  0.34729600  0.84208000  0.09120000  1
  Mn  Mn24  1  0.96191000  0.82120100  0.41249700  1
  Mn  Mn25  1  0.97414000  0.49380500  0.74543100  1
  Mn  Mn26  1  0.03693800  0.15826800  0.07958100  1
  Mn  Mn27  1  0.47414000  0.50619500  0.75456900  1
  Mn  Mn28  1  0.53693800  0.84173200  0.42041900  1
  Mn  Mn29  1  0.46191000  0.17879900  0.08750300  1
  Mn  Mn30  1  0.53809000  0.82120100  0.91249700  1
  Mn  Mn31  1  0.46306200  0.15826800  0.57958100  1
  Mn  Mn32  1  0.52586000  0.49380500  0.24543100  1
  Mn  Mn33  1  0.96306200  0.84173200  0.92041900  1
  Mn  Mn34  1  0.02586000  0.50619500  0.25456900  1
  Mn  Mn35  1  0.03809000  0.17879900  0.58750300  1
  F  F36  1  0.55372500  0.92874200  0.12956300  1
  F  F37  1  0.92592200  0.90923000  0.14586700  1
  F  F38  1  0.75662000  0.62288600  0.46344400  1
  F  F39  1  0.02876200  0.72908700  0.32495300  1
  F  F40  1  0.38988900  0.71740900  0.36754400  1
  F  F41  1  0.70542700  0.32426200  0.79118800  1
  F  F42  1  0.24690700  0.06403900  0.02858700  1
  F  F43  1  0.28446100  0.40250200  0.70241800  1
  F  F44  1  0.46990100  0.67008300  0.55065500  1
  F  F45  1  0.59916900  0.27462000  0.97168700  1
  F  F46  1  0.78944900  0.60333600  0.64591700  1
  F  F47  1  0.24071100  0.05366900  0.18875400  1
  F  F48  1  0.28944900  0.39666400  0.85408300  1
  F  F49  1  0.74071100  0.94633100  0.31124600  1
  F  F50  1  0.09916900  0.72538000  0.52831300  1
  F  F51  1  0.96990100  0.32991700  0.94934500  1
  F  F52  1  0.78446100  0.59749800  0.79758200  1
  F  F53  1  0.20542700  0.67573800  0.70881200  1
  F  F54  1  0.74690700  0.93596100  0.47141300  1
  F  F55  1  0.88988900  0.28259100  0.13245600  1
  F  F56  1  0.52876200  0.27091300  0.17504700  1
  F  F57  1  0.25662000  0.37711400  0.03655600  1
  F  F58  1  0.42592200  0.09077000  0.35413300  1
  F  F59  1  0.05372500  0.07125800  0.37043700  1
  F  F60  1  0.94627500  0.92874200  0.62956300  1
  F  F61  1  0.57407800  0.90923000  0.64586700  1
  F  F62  1  0.74338000  0.62288600  0.96344400  1
  F  F63  1  0.47123800  0.72908700  0.82495300  1
  F  F64  1  0.11011100  0.71740900  0.86754400  1
  F  F65  1  0.25309300  0.06403900  0.52858700  1
  F  F66  1  0.79457300  0.32426200  0.29118800  1
  F  F67  1  0.21553900  0.40250200  0.20241800  1
  F  F68  1  0.03009900  0.67008300  0.05065500  1
  F  F69  1  0.90083100  0.27462000  0.47168700  1
  F  F70  1  0.25928900  0.05366900  0.68875400  1
  F  F71  1  0.71055100  0.60333600  0.14591700  1
  F  F72  1  0.75928900  0.94633100  0.81124600  1
  F  F73  1  0.21055100  0.39666400  0.35408300  1
  F  F74  1  0.40083100  0.72538000  0.02831300  1
  F  F75  1  0.53009900  0.32991700  0.44934500  1
  F  F76  1  0.71553900  0.59749800  0.29758200  1
  F  F77  1  0.75309300  0.93596100  0.97141300  1
  F  F78  1  0.29457300  0.67573800  0.20881200  1
  F  F79  1  0.61011100  0.28259100  0.63245600  1
  F  F80  1  0.97123800  0.27091300  0.67504700  1
  F  F81  1  0.24338000  0.37711400  0.53655600  1
  F  F82  1  0.07407800  0.09077000  0.85413300  1
  F  F83  1  0.44627500  0.07125800  0.87043700  1
