# generated using pymatgen
data_LiVCrP2(O4F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16306400
_cell_length_b   7.33087889
_cell_length_c   14.65600245
_cell_angle_alpha   92.04194075
_cell_angle_beta   93.53204859
_cell_angle_gamma   106.09824179
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiVCrP2(O4F)2
_chemical_formula_sum   'Li3 V3 Cr3 P6 O24 F6'
_cell_volume   531.15788805
_cell_formula_units_Z   3
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  0.06953800  0.32743000  0.14599700  1
  Li  Li1  1  0.40122500  0.65817500  0.47814900  1
  Li  Li2  1  0.93232700  0.67412000  0.85302600  1
  V  V3  1  0.99975600  0.00003300  0.99977000  1
  V  V4  1  0.33342300  0.32811300  0.33485500  1
  V  V5  1  0.66606300  0.66665100  0.66637400  1
  Cr  Cr6  1  0.00465600  0.00315600  0.50057400  1
  Cr  Cr7  1  0.32698700  0.32904400  0.83206800  1
  Cr  Cr8  1  0.67162700  0.66987500  0.16703900  1
  P  P9  1  0.27040100  0.94574500  0.70668300  1
  P  P10  1  0.06214100  0.38706700  0.62663700  1
  P  P11  1  0.40020700  0.71666900  0.96290200  1
  P  P12  1  0.59905500  0.28284100  0.03698200  1
  P  P13  1  0.93270100  0.61423700  0.37116700  1
  P  P14  1  0.72989200  0.05138500  0.29426600  1
  O  O15  1  0.09243600  0.77662900  0.44001600  1
  O  O16  1  0.23302400  0.86743100  0.95413600  1
  O  O17  1  0.25197300  0.99561500  0.60702000  1
  O  O18  1  0.07921200  0.33692900  0.72643000  1
  O  O19  1  0.10660200  0.46778000  0.38193500  1
  O  O20  1  0.23948100  0.55760000  0.89283200  1
  O  O21  1  0.01136300  0.16321100  0.26191300  1
  O  O22  1  0.44956000  0.80236400  0.71324000  1
  O  O23  1  0.34333700  0.49652200  0.59366800  1
  O  O24  1  0.40403200  0.65572700  0.06103500  1
  O  O25  1  0.58378900  0.88922200  0.22588200  1
  O  O26  1  0.69064400  0.80748500  0.93235500  1
  O  O27  1  0.30896700  0.19243100  0.06801900  1
  O  O28  1  0.41565600  0.11178900  0.77352200  1
  O  O29  1  0.59419400  0.34330300  0.93896400  1
  O  O30  1  0.64296100  0.52607600  0.40213100  1
  O  O31  1  0.55676900  0.19980600  0.28923400  1
  O  O32  1  0.98952700  0.83673400  0.74008800  1
  O  O33  1  0.75997900  0.44234800  0.10716500  1
  O  O34  1  0.88376100  0.53112300  0.62059700  1
  O  O35  1  0.92852100  0.66592200  0.27165400  1
  O  O36  1  0.74601500  0.99320600  0.39265000  1
  O  O37  1  0.76732500  0.13293300  0.04637100  1
  O  O38  1  0.91728000  0.22134000  0.55986500  1
  F  F39  1  0.03548900  0.15402500  0.89454900  1
  F  F40  1  0.36989300  0.48629700  0.22487300  1
  F  F41  1  0.29808300  0.17713200  0.44026300  1
  F  F42  1  0.70074200  0.82152400  0.55718000  1
  F  F43  1  0.63014800  0.51150800  0.77595600  1
  F  F44  1  0.96281600  0.84590300  0.10547600  1
