# generated using pymatgen
data_Li3Fe2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.26249100
_cell_length_b   8.27949382
_cell_length_c   9.44364481
_cell_angle_alpha   106.58364930
_cell_angle_beta   107.26796488
_cell_angle_gamma   103.21419071
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2P2(CO7)2
_chemical_formula_sum   'Li6 Fe4 P4 C4 O28'
_cell_volume   555.52625721
_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  0.93113600  0.19233200  0.89436000  1
  Li  Li1  1  0.43962300  0.69348500  0.89623000  1
  Li  Li2  1  0.71698000  0.75323400  0.71881900  1
  Li  Li3  1  0.28302000  0.24676600  0.28118100  1
  Li  Li4  1  0.06886400  0.80766800  0.10564000  1
  Li  Li5  1  0.56037700  0.30651500  0.10377000  1
  Fe  Fe6  1  0.06560300  0.80813800  0.66617200  1
  Fe  Fe7  1  0.55701100  0.30542700  0.67100000  1
  Fe  Fe8  1  0.93439700  0.19186200  0.33382800  1
  Fe  Fe9  1  0.44298900  0.69457300  0.32900000  1
  P  P10  1  0.30724100  0.54755700  0.57606300  1
  P  P11  1  0.79975000  0.05032300  0.57952600  1
  P  P12  1  0.69275900  0.45244300  0.42393700  1
  P  P13  1  0.20025000  0.94967700  0.42047400  1
  C  C14  1  0.75276200  0.50522100  0.95913800  1
  C  C15  1  0.24349300  0.00628000  0.96022200  1
  C  C16  1  0.75650700  0.99372000  0.03977800  1
  C  C17  1  0.24723800  0.49477900  0.04086200  1
  O  O18  1  0.10766800  0.86368800  0.92570200  1
  O  O19  1  0.62043100  0.36366700  0.92960500  1
  O  O20  1  0.66130700  0.87517800  0.90008400  1
  O  O21  1  0.76821300  0.52995900  0.83152100  1
  O  O22  1  0.13533300  0.38450300  0.90474000  1
  O  O23  1  0.27774900  0.02116300  0.83729400  1
  O  O24  1  0.90032700  0.96771100  0.69244500  1
  O  O25  1  0.73141100  0.17192000  0.68903200  1
  O  O26  1  0.22379100  0.65838500  0.67630400  1
  O  O27  1  0.41989200  0.48177300  0.69690100  1
  O  O28  1  0.83169500  0.60852900  0.57990300  1
  O  O29  1  0.92886000  0.16404400  0.52737000  1
  O  O30  1  0.44226600  0.66991500  0.53158700  1
  O  O31  1  0.35218400  0.09478000  0.57453600  1
  O  O32  1  0.64781600  0.90522000  0.42546400  1
  O  O33  1  0.55773400  0.33008500  0.46841300  1
  O  O34  1  0.07114000  0.83595600  0.47263000  1
  O  O35  1  0.16830500  0.39147100  0.42009700  1
  O  O36  1  0.58010800  0.51822700  0.30309900  1
  O  O37  1  0.77620900  0.34161500  0.32369600  1
  O  O38  1  0.26858900  0.82808000  0.31096800  1
  O  O39  1  0.09967300  0.03228900  0.30755500  1
  O  O40  1  0.72225100  0.97883700  0.16270600  1
  O  O41  1  0.86466700  0.61549700  0.09526000  1
  O  O42  1  0.23178700  0.47004100  0.16847900  1
  O  O43  1  0.33869300  0.12482200  0.09991600  1
  O  O44  1  0.37956900  0.63633300  0.07039500  1
  O  O45  1  0.89233200  0.13631200  0.07429800  1
