# generated using pymatgen
data_LiCrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.95490816
_cell_length_b   7.95490850
_cell_length_c   10.48992031
_cell_angle_alpha   88.26967111
_cell_angle_beta   91.73033275
_cell_angle_gamma   65.44205189
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrP2O7
_chemical_formula_sum   'Li4 Cr4 P8 O28'
_cell_volume   602.81821782
_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  0.27811100  0.27854400  0.00068400  1
  Li  Li1  1  0.72188900  0.72145700  0.99931700  1
  Li  Li2  1  0.72145700  0.72188800  0.50068400  1
  Li  Li3  1  0.27854400  0.27811200  0.49931700  1
  Cr  Cr4  1  0.67314400  0.32639300  0.09304200  1
  Cr  Cr5  1  0.67360700  0.32685600  0.59304200  1
  Cr  Cr6  1  0.32639300  0.67314500  0.40695700  1
  Cr  Cr7  1  0.32685500  0.67360800  0.90695700  1
  P  P8  1  0.67279400  0.10987700  0.85794700  1
  P  P9  1  0.32720600  0.89012400  0.14205300  1
  P  P10  1  0.68165400  0.10687600  0.35890800  1
  P  P11  1  0.89312300  0.31834600  0.85890800  1
  P  P12  1  0.10987600  0.67279500  0.64205300  1
  P  P13  1  0.10687600  0.68165400  0.14109200  1
  P  P14  1  0.31834600  0.89312400  0.64109200  1
  P  P15  1  0.89012400  0.32720600  0.35794700  1
  O  O16  1  0.24661600  0.54926300  0.54101400  1
  O  O17  1  0.71275900  0.91183800  0.38159500  1
  O  O18  1  0.91664800  0.69713900  0.62066000  1
  O  O19  1  0.91183800  0.71275900  0.11840500  1
  O  O20  1  0.08816200  0.28724100  0.88159500  1
  O  O21  1  0.08335300  0.30286000  0.37933900  1
  O  O22  1  0.28724100  0.08816300  0.61840500  1
  O  O23  1  0.30286100  0.08335200  0.12066100  1
  O  O24  1  0.19788400  0.60232300  0.77711100  1
  O  O25  1  0.19223100  0.61026100  0.27676500  1
  O  O26  1  0.24151000  0.55416800  0.04074600  1
  O  O27  1  0.38973900  0.80777000  0.77676500  1
  O  O28  1  0.12200300  0.87306500  0.61871300  1
  O  O29  1  0.12693600  0.87799700  0.11871300  1
  O  O30  1  0.54926200  0.24661600  0.95898600  1
  O  O31  1  0.80211600  0.39767600  0.22288900  1
  O  O32  1  0.60232400  0.19788400  0.72288900  1
  O  O33  1  0.61026100  0.19223100  0.22323500  1
  O  O34  1  0.69713900  0.91664800  0.87933900  1
  O  O35  1  0.39767600  0.80211500  0.27711100  1
  O  O36  1  0.44583200  0.75849000  0.54074700  1
  O  O37  1  0.45073800  0.75338400  0.04101400  1
  O  O38  1  0.87306600  0.12200200  0.88128700  1
  O  O39  1  0.87799800  0.12693600  0.38128700  1
  O  O40  1  0.75338500  0.45073800  0.45898600  1
  O  O41  1  0.75849000  0.44583200  0.95925400  1
  O  O42  1  0.80776900  0.38973900  0.72323400  1
  O  O43  1  0.55416900  0.24151000  0.45925400  1
