# generated using pymatgen
data_Li2VCr(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.02079400
_cell_length_b   8.22183215
_cell_length_c   14.01517605
_cell_angle_alpha   90.01238718
_cell_angle_beta   99.53886440
_cell_angle_gamma   90.11357654
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2VCr(P2O7)2
_chemical_formula_sum   'Li6 V3 Cr3 P12 O42'
_cell_volume   797.82155978
_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  0.38186300  0.86318200  0.05889300  1
  Li  Li1  1  0.95135900  0.36322300  0.27447600  1
  Li  Li2  1  0.71546900  0.86286500  0.39214800  1
  Li  Li3  1  0.28455300  0.36288800  0.60788400  1
  Li  Li4  1  0.04833800  0.86329500  0.72559000  1
  Li  Li5  1  0.61762300  0.36278200  0.94125100  1
  V  V6  1  0.34310100  0.49956600  0.07216000  1
  V  V7  1  0.99063300  0.99935900  0.26119500  1
  V  V8  1  0.00919500  0.49945500  0.73882900  1
  Cr  Cr9  1  0.67770500  0.49998700  0.40488200  1
  Cr  Cr10  1  0.32266200  0.99980400  0.59527600  1
  Cr  Cr11  1  0.65544200  0.99981000  0.92852700  1
  P  P12  1  0.61151900  0.17986300  0.13302000  1
  P  P13  1  0.98375000  0.78455600  0.06990500  1
  P  P14  1  0.34963800  0.28464400  0.26319800  1
  P  P15  1  0.72190300  0.67976600  0.20023600  1
  P  P16  1  0.31991100  0.78335600  0.40459700  1
  P  P17  1  0.05568300  0.68046300  0.53310200  1
  P  P18  1  0.94441100  0.18053300  0.46698100  1
  P  P19  1  0.68010200  0.28336100  0.59535400  1
  P  P20  1  0.27921700  0.17954000  0.79986900  1
  P  P21  1  0.65113300  0.78587000  0.73715200  1
  P  P22  1  0.01420700  0.28206400  0.92913600  1
  P  P23  1  0.38994700  0.68076500  0.86651800  1
  O  O24  1  0.16427300  0.32245000  0.01711200  1
  O  O25  1  0.15810100  0.69633700  0.04302200  1
  O  O26  1  0.05020300  0.93471100  0.13225000  1
  O  O27  1  0.58036700  0.03660500  0.06217700  1
  O  O28  1  0.57743900  0.34426800  0.08204400  1
  O  O29  1  0.52636200  0.67831700  0.13229300  1
  O  O30  1  0.28364000  0.43477800  0.20099100  1
  O  O31  1  0.44482800  0.15246800  0.19814500  1
  O  O32  1  0.88826300  0.65228400  0.13506700  1
  O  O33  1  0.17495600  0.19660800  0.29010100  1
  O  O34  1  0.16956900  0.82258200  0.31633800  1
  O  O35  1  0.80700500  0.17837200  0.20099000  1
  O  O36  1  0.75601500  0.84416000  0.25117200  1
  O  O37  1  0.75276800  0.53656800  0.27118100  1
  O  O38  1  0.49901800  0.32429200  0.35130300  1
  O  O39  1  0.49383600  0.69334200  0.37710100  1
  O  O40  1  0.22235600  0.65150500  0.46847400  1
  O  O41  1  0.38395800  0.93376000  0.46635600  1
  O  O42  1  0.14017600  0.17955600  0.53382500  1
  O  O43  1  0.91311900  0.03808800  0.39540600  1
  O  O44  1  0.90684200  0.34606800  0.41623800  1
  O  O45  1  0.09323600  0.84596700  0.58382600  1
  O  O46  1  0.08666000  0.53807400  0.60476100  1
  O  O47  1  0.85990800  0.67944500  0.46622600  1
  O  O48  1  0.61635400  0.43377100  0.53370200  1
  O  O49  1  0.77752000  0.15167200  0.53164300  1
  O  O50  1  0.50601500  0.19348200  0.62294900  1
  O  O51  1  0.50138800  0.82433500  0.64883900  1
  O  O52  1  0.24691600  0.03653100  0.72882000  1
  O  O53  1  0.24414100  0.34427000  0.74917600  1
  O  O54  1  0.19356700  0.67936100  0.79952100  1
  O  O55  1  0.83053000  0.32273200  0.68369300  1
  O  O56  1  0.82501100  0.69702100  0.70981600  1
  O  O57  1  0.11133000  0.15162800  0.86467300  1
  O  O58  1  0.55545100  0.65228300  0.80157900  1
  O  O59  1  0.71605500  0.93512000  0.79989000  1
  O  O60  1  0.47419200  0.17846000  0.86761600  1
  O  O61  1  0.42667600  0.84602500  0.91746300  1
  O  O62  1  0.41983200  0.53822200  0.93798300  1
  O  O63  1  0.94887800  0.43330000  0.86787000  1
  O  O64  1  0.83955200  0.19284300  0.95626100  1
  O  O65  1  0.83433000  0.82408300  0.98192900  1
