# generated using pymatgen
data_Li2CrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.70929600
_cell_length_b   5.10407000
_cell_length_c   7.96544031
_cell_angle_alpha   86.56731698
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CrP2O7
_chemical_formula_sum   'Li8 Cr4 P8 O28'
_cell_volume   556.36739037
_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  0.10059800  0.19167100  0.85871100  1
  Li  Li1  1  0.89940200  0.80832900  0.14128900  1
  Li  Li2  1  0.30247400  0.26037000  0.17097300  1
  Li  Li3  1  0.80247400  0.23963000  0.32902700  1
  Li  Li4  1  0.39940200  0.69167100  0.35871100  1
  Li  Li5  1  0.69752600  0.73963000  0.82902700  1
  Li  Li6  1  0.19752600  0.76037000  0.67097300  1
  Li  Li7  1  0.60059800  0.30832900  0.64128900  1
  Cr  Cr8  1  0.15323200  0.78749900  0.24131600  1
  Cr  Cr9  1  0.65323200  0.71250100  0.25868400  1
  Cr  Cr10  1  0.34676800  0.28749900  0.74131600  1
  Cr  Cr11  1  0.84676800  0.21250100  0.75868400  1
  P  P12  1  0.82661600  0.73129600  0.53000500  1
  P  P13  1  0.17338400  0.26870400  0.46999500  1
  P  P14  1  0.52492600  0.21185000  0.27627800  1
  P  P15  1  0.02492600  0.28815000  0.22372200  1
  P  P16  1  0.32661600  0.76870400  0.96999500  1
  P  P17  1  0.97507400  0.71185000  0.77627800  1
  P  P18  1  0.67338400  0.23129600  0.03000500  1
  P  P19  1  0.47507400  0.78815000  0.72372200  1
  O  O20  1  0.94174800  0.73570200  0.57673800  1
  O  O21  1  0.10193500  0.12980500  0.12769500  1
  O  O22  1  0.55825200  0.23570200  0.07673800  1
  O  O23  1  0.71071500  0.51288500  0.04658800  1
  O  O24  1  0.28928500  0.48711500  0.95341200  1
  O  O25  1  0.44174800  0.76429800  0.92326200  1
  O  O26  1  0.89806500  0.87019500  0.87230500  1
  O  O27  1  0.27860000  0.96055300  0.83673000  1
  O  O28  1  0.68292900  0.13499300  0.85266700  1
  O  O29  1  0.96949100  0.41528300  0.82684700  1
  O  O30  1  0.07550300  0.83112400  0.78108200  1
  O  O31  1  0.57550300  0.66887600  0.71891800  1
  O  O32  1  0.77860000  0.53944700  0.66327000  1
  O  O33  1  0.31707100  0.86500700  0.14733300  1
  O  O34  1  0.18292900  0.36500700  0.64733300  1
  O  O35  1  0.39806500  0.62980500  0.62769500  1
  O  O36  1  0.46949100  0.08471700  0.67315300  1
  O  O37  1  0.78928500  0.01288500  0.54658800  1
  O  O38  1  0.21071500  0.98711500  0.45341200  1
  O  O39  1  0.05825200  0.26429800  0.42326200  1
  O  O40  1  0.60193500  0.37019500  0.37230500  1
  O  O41  1  0.81707100  0.63499300  0.35266700  1
  O  O42  1  0.53050900  0.91528300  0.32684700  1
  O  O43  1  0.22140000  0.46055300  0.33673000  1
  O  O44  1  0.42449700  0.33112400  0.28108200  1
  O  O45  1  0.92449700  0.16887600  0.21891800  1
  O  O46  1  0.03050900  0.58471700  0.17315300  1
  O  O47  1  0.72140000  0.03944700  0.16327000  1
