# generated using pymatgen
data_Li2CrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.81355543
_cell_length_b   7.81355543
_cell_length_c   7.97725850
_cell_angle_alpha   64.12498879
_cell_angle_beta   64.12498879
_cell_angle_gamma   42.25541684
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CrP2O7
_chemical_formula_sum   'Li4 Cr2 P4 O14'
_cell_volume   289.43963089
_cell_formula_units_Z   2
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  0.06401400  0.37544000  0.18978500  1
  Li  Li1  1  0.37544000  0.06401400  0.68978500  1
  Li  Li2  1  0.93598600  0.62456000  0.81021500  1
  Li  Li3  1  0.62456000  0.93598600  0.31021500  1
  Cr  Cr4  1  0.00000000  0.00000000  0.50000000  1
  Cr  Cr5  1  0.00000000  0.00000000  0.00000000  1
  P  P6  1  0.24785900  0.52585000  0.35619800  1
  P  P7  1  0.75214100  0.47415000  0.64380200  1
  P  P8  1  0.47415000  0.75214100  0.14380200  1
  P  P9  1  0.52585000  0.24785900  0.85619800  1
  O  O10  1  0.25338000  0.35844100  0.91691700  1
  O  O11  1  0.33971900  0.88506300  0.97135600  1
  O  O12  1  0.35844100  0.25338000  0.41691700  1
  O  O13  1  0.06266800  0.69827100  0.21468200  1
  O  O14  1  0.30172900  0.93733200  0.28531800  1
  O  O15  1  0.66028100  0.11493700  0.02864400  1
  O  O16  1  0.11493700  0.66028100  0.52864400  1
  O  O17  1  0.69827100  0.06266800  0.71468200  1
  O  O18  1  0.50705200  0.49294800  0.75000000  1
  O  O19  1  0.74662000  0.64155900  0.08308300  1
  O  O20  1  0.49294800  0.50705200  0.25000000  1
  O  O21  1  0.64155900  0.74662000  0.58308300  1
  O  O22  1  0.93733200  0.30172900  0.78531800  1
  O  O23  1  0.88506300  0.33971900  0.47135600  1
