# generated using pymatgen
data_Li3CrPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.45293400
_cell_length_b   8.68386840
_cell_length_c   9.97601032
_cell_angle_alpha   94.63690460
_cell_angle_beta   90.10049155
_cell_angle_gamma   90.20833091
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3CrPCO7
_chemical_formula_sum   'Li12 Cr4 P4 C4 O28'
_cell_volume   557.18547733
_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  0.74072300  0.11354800  0.60648900  1
  Li  Li1  1  0.74656600  0.10645500  0.12090700  1
  Li  Li2  1  0.51436500  0.27525300  0.86256500  1
  Li  Li3  1  0.98268500  0.27457700  0.38641500  1
  Li  Li4  1  0.51699400  0.27457000  0.38440200  1
  Li  Li5  1  0.25290200  0.35019400  0.59646100  1
  Li  Li6  1  0.47046300  0.72154600  0.62447900  1
  Li  Li7  1  0.03056600  0.71924900  0.62371800  1
  Li  Li8  1  0.47468300  0.72665400  0.13060600  1
  Li  Li9  1  0.02476200  0.72694800  0.12979700  1
  Li  Li10  1  0.25142000  0.89584700  0.88139900  1
  Li  Li11  1  0.25017000  0.89863100  0.38797400  1
  Cr  Cr12  1  0.00504600  0.26200200  0.85327200  1
  Cr  Cr13  1  0.25287300  0.33676900  0.11792000  1
  Cr  Cr14  1  0.74737400  0.66373900  0.89380300  1
  Cr  Cr15  1  0.74983100  0.66592900  0.39669600  1
  P  P16  1  0.74877200  0.40993300  0.63808900  1
  P  P17  1  0.74984100  0.41280700  0.14079900  1
  P  P18  1  0.24708800  0.58766900  0.85596700  1
  P  P19  1  0.24980100  0.58606000  0.35876000  1
  C  C20  1  0.24700800  0.03442800  0.64959300  1
  C  C21  1  0.24894600  0.02979100  0.14748500  1
  C  C22  1  0.75363200  0.96681100  0.85180100  1
  C  C23  1  0.75006000  0.96781500  0.35352300  1
  O  O24  1  0.24917200  0.06748800  0.52737100  1
  O  O25  1  0.76445200  0.10697600  0.80768600  1
  O  O26  1  0.24571200  0.05708000  0.02249500  1
  O  O27  1  0.24856300  0.14534700  0.74846400  1
  O  O28  1  0.75021000  0.10830600  0.31711700  1
  O  O29  1  0.25192600  0.14642000  0.23923400  1
  O  O30  1  0.94130600  0.31489600  0.58950700  1
  O  O31  1  0.55896800  0.31385800  0.58605300  1
  O  O32  1  0.93881500  0.31412100  0.08426900  1
  O  O33  1  0.56319800  0.31328100  0.08232100  1
  O  O34  1  0.24272200  0.42099700  0.90589600  1
  O  O35  1  0.74827600  0.42012700  0.79741800  1
  O  O36  1  0.24911100  0.42064200  0.40168500  1
  O  O37  1  0.75018100  0.42030700  0.29597400  1
  O  O38  1  0.25006700  0.57461700  0.70162100  1
  O  O39  1  0.74980100  0.57823500  0.59530300  1
  O  O40  1  0.25035500  0.58130500  0.20204700  1
  O  O41  1  0.75159100  0.57772700  0.09306800  1
  O  O42  1  0.06115900  0.68667500  0.91293900  1
  O  O43  1  0.43519500  0.68200800  0.91702200  1
  O  O44  1  0.43676100  0.68657300  0.41571300  1
  O  O45  1  0.06357000  0.68630700  0.41503900  1
  O  O46  1  0.74233800  0.84877800  0.76419600  1
  O  O47  1  0.24718200  0.89107700  0.68182500  1
  O  O48  1  0.75000600  0.84994200  0.26198900  1
  O  O49  1  0.75310800  0.94926900  0.97756000  1
  O  O50  1  0.24986100  0.88976600  0.18487100  1
  O  O51  1  0.74982600  0.94064300  0.47839800  1
