# generated using pymatgen
data_LiCrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.44956000
_cell_length_b   5.04158100
_cell_length_c   9.50203015
_cell_angle_alpha   58.57778139
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrP2O7
_chemical_formula_sum   'Li4 Cr4 P8 O28'
_cell_volume   549.81648506
_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  0.38018300  0.98982200  0.35649100  1
  Li  Li1  1  0.88018300  0.01017800  0.14350900  1
  Li  Li2  1  0.11981700  0.98982200  0.85649100  1
  Li  Li3  1  0.61981700  0.01017800  0.64350900  1
  Cr  Cr4  1  0.66786700  0.02679000  0.26615500  1
  Cr  Cr5  1  0.83213300  0.02679000  0.76615500  1
  Cr  Cr6  1  0.33213300  0.97321000  0.73384500  1
  Cr  Cr7  1  0.16786700  0.97321000  0.23384500  1
  P  P8  1  0.47117600  0.48157200  0.72556400  1
  P  P9  1  0.52882400  0.51842800  0.27443600  1
  P  P10  1  0.82187400  0.73072200  0.53939000  1
  P  P11  1  0.67812600  0.73072200  0.03939000  1
  P  P12  1  0.02882400  0.48157200  0.22556400  1
  P  P13  1  0.32187400  0.26927800  0.96061000  1
  P  P14  1  0.17812600  0.26927800  0.46061000  1
  P  P15  1  0.97117600  0.51842800  0.77443600  1
  O  O16  1  0.04430700  0.22010500  0.18520500  1
  O  O17  1  0.78442100  0.41355500  0.57572700  1
  O  O18  1  0.39231400  0.74400900  0.63162900  1
  O  O19  1  0.42497200  0.40604400  0.29056900  1
  O  O20  1  0.93970500  0.69292600  0.57622600  1
  O  O21  1  0.06029500  0.30707400  0.42377400  1
  O  O22  1  0.89231400  0.25599100  0.86837100  1
  O  O23  1  0.77473800  0.82981400  0.65144200  1
  O  O24  1  0.54430700  0.77989500  0.31479500  1
  O  O25  1  0.07502800  0.40604400  0.79056900  1
  O  O26  1  0.43970500  0.30707400  0.92377400  1
  O  O27  1  0.80611200  0.97388400  0.35635000  1
  O  O28  1  0.57502800  0.59395600  0.70943100  1
  O  O29  1  0.28442100  0.58644500  0.92427300  1
  O  O30  1  0.45569300  0.22010500  0.68520500  1
  O  O31  1  0.60768600  0.25599100  0.36837100  1
  O  O32  1  0.71557900  0.41355500  0.07572700  1
  O  O33  1  0.19388800  0.02611600  0.64365000  1
  O  O34  1  0.10768600  0.74400900  0.13162900  1
  O  O35  1  0.92497200  0.59395600  0.20943100  1
  O  O36  1  0.95569300  0.77989500  0.81479500  1
  O  O37  1  0.56029500  0.69292600  0.07622600  1
  O  O38  1  0.69388800  0.97388400  0.85635000  1
  O  O39  1  0.22526200  0.17018600  0.34855800  1
  O  O40  1  0.72526200  0.82981400  0.15144200  1
  O  O41  1  0.30611200  0.02611600  0.14365000  1
  O  O42  1  0.27473800  0.17018600  0.84855800  1
  O  O43  1  0.21557900  0.58644500  0.42427300  1
