# generated using pymatgen
data_LiVCr(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.16449800
_cell_length_b   9.68514565
_cell_length_c   16.85099222
_cell_angle_alpha   102.09368360
_cell_angle_beta   96.13944530
_cell_angle_gamma   111.37101126
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiVCr(P2O7)2
_chemical_formula_sum   'Li4 V4 Cr4 P16 O56'
_cell_volume   1042.91729945
_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  0.29055300  0.96599300  0.43195600  1
  Li  Li1  1  0.26304900  0.59098400  0.68126500  1
  Li  Li2  1  0.01478700  0.34285800  0.18171300  1
  Li  Li3  1  0.53946200  0.21573900  0.93182800  1
  V  V4  1  0.15709000  0.87854000  0.24741900  1
  V  V5  1  0.90531500  0.63351600  0.75336700  1
  V  V6  1  0.65522700  0.38486400  0.25385200  1
  V  V7  1  0.40720900  0.12989700  0.74799400  1
  Cr  Cr8  1  0.72385100  0.99563600  0.50309800  1
  Cr  Cr9  1  0.46917800  0.74470400  0.00221400  1
  Cr  Cr10  1  0.21693700  0.49255600  0.49878800  1
  Cr  Cr11  1  0.97125800  0.24308000  0.99959900  1
  P  P12  1  0.33184700  0.85473400  0.59018600  1
  P  P13  1  0.08325400  0.60479300  0.08885700  1
  P  P14  1  0.79490300  0.88009800  0.89183500  1
  P  P15  1  0.54574500  0.63174100  0.39197700  1
  P  P16  1  0.97081400  0.88609900  0.64126000  1
  P  P17  1  0.72205400  0.63642800  0.14079100  1
  P  P18  1  0.38352200  0.85876000  0.84200700  1
  P  P19  1  0.13406800  0.60934000  0.34152800  1
  P  P20  1  0.83583100  0.35450500  0.58833700  1
  P  P21  1  0.58452200  0.10413000  0.08968300  1
  P  P22  1  0.29307600  0.38216500  0.89096700  1
  P  P23  1  0.04232600  0.13076100  0.39090100  1
  P  P24  1  0.47619300  0.38733200  0.64085300  1
  P  P25  1  0.22456400  0.13681700  0.14120300  1
  P  P26  1  0.87865600  0.35673200  0.83829100  1
  P  P27  1  0.62791400  0.10616100  0.33867600  1
  O  O28  1  0.55234500  0.94263600  0.09049900  1
  O  O29  1  0.45506300  0.98587300  0.26901000  1
  O  O30  1  0.13344800  0.98525900  0.16518600  1
  O  O31  1  0.80314400  0.91406800  0.59538900  1
  O  O32  1  0.55371400  0.66377000  0.09526900  1
  O  O33  1  0.66130000  0.80460900  0.41224300  1
  O  O34  1  0.42774700  0.91127000  0.52051500  1
  O  O35  1  0.18241700  0.65749500  0.02061700  1
  O  O36  1  0.44611300  0.96486000  0.67620100  1
  O  O37  1  0.19418700  0.71378100  0.17627300  1
  O  O38  1  0.16638800  0.77470000  0.33773000  1
  O  O39  1  0.86295700  0.76747200  0.21748000  1
  O  O40  1  0.10935400  0.86174600  0.57390000  1
  O  O41  1  0.85911300  0.61009600  0.07381300  1
  O  O42  1  0.58502300  0.83315700  0.82311000  1
  O  O43  1  0.33523400  0.58316200  0.32296800  1
  O  O44  1  0.73859600  0.82441500  0.96698700  1
  O  O45  1  0.48758100  0.57377300  0.46650100  1
  O  O46  1  0.30200900  0.69136500  0.59124300  1
  O  O47  1  0.04869800  0.43981100  0.09102500  1
  O  O48  1  0.35283300  0.84062300  0.92668600  1
  O  O49  1  0.10284900  0.59124200  0.42635500  1
  O  O50  1  0.21401500  0.73535200  0.77031100  1
  O  O51  1  0.96400000  0.48549200  0.27038200  1
  O  O52  1  0.88689900  0.73657100  0.66894700  1
  O  O53  1  0.63748200  0.48671200  0.16923200  1
  O  O54  1  0.90939900  0.79849800  0.84124900  1
  O  O55  1  0.66029500  0.54958200  0.34157500  1
  O  O56  1  0.30770600  0.42287400  0.59868100  1
  O  O57  1  0.05690300  0.17281200  0.09836100  1
  O  O58  1  0.40969100  0.55386800  0.91022100  1
  O  O59  1  0.16011000  0.30281400  0.40936200  1
  O  O60  1  0.93353300  0.40935600  0.51961200  1
  O  O61  1  0.67857100  0.16245600  0.01932000  1
  O  O62  1  0.95334000  0.47078500  0.67411800  1
  O  O63  1  0.70535900  0.22143900  0.17391600  1
  O  O64  1  0.91323700  0.52118700  0.83372800  1
  O  O65  1  0.66252700  0.27048800  0.33302500  1
  O  O66  1  0.60650600  0.51970600  0.71834200  1
  O  O67  1  0.35531200  0.26989200  0.21816400  1
  O  O68  1  0.61226500  0.36526900  0.57428200  1
  O  O69  1  0.36272600  0.11661400  0.07454600  1
  O  O70  1  0.08268400  0.33215700  0.82344200  1
  O  O71  1  0.83227200  0.08208500  0.32367100  1
  O  O72  1  0.24202400  0.32367400  0.96681200  1
  O  O73  1  0.99325200  0.07441900  0.46736000  1
  O  O74  1  0.79872500  0.19149500  0.59023500  1
  O  O75  1  0.84289800  0.33424100  0.92351400  1
  O  O76  1  0.59241600  0.08398600  0.42380600  1
  O  O77  1  0.70525300  0.23599000  0.76910400  1
  O  O78  1  0.38461200  0.23559600  0.66564300  1
  O  O79  1  0.40781000  0.29402600  0.84412100  1
  O  O80  1  0.15716500  0.04334800  0.34391600  1
  O  O81  1  0.91207000  0.05332300  0.91133300  1
  O  O82  1  0.41600200  0.02427500  0.83744500  1
  O  O83  1  0.11243500  0.01754000  0.71744000  1
