# generated using pymatgen
data_Li3Fe2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47815200
_cell_length_b   9.44350300
_cell_length_c   10.17653491
_cell_angle_alpha   62.96487512
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2P2(CO7)2
_chemical_formula_sum   'Li6 Fe4 P4 C4 O28'
_cell_volume   554.53544092
_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  0.74971800  0.66903600  0.43756200  1
  Li  Li1  1  0.75388400  0.16802400  0.93314200  1
  Li  Li2  1  0.53627600  0.51630800  0.76627000  1
  Li  Li3  1  0.03627600  0.48369200  0.23373000  1
  Li  Li4  1  0.25388400  0.83197600  0.06685800  1
  Li  Li5  1  0.24971800  0.33096400  0.56243800  1
  Fe  Fe6  1  0.24720500  0.26163000  0.06837000  1
  Fe  Fe7  1  0.24476300  0.77071900  0.56358900  1
  Fe  Fe8  1  0.74476300  0.22928100  0.43641100  1
  Fe  Fe9  1  0.74720500  0.73837000  0.93163000  1
  P  P10  1  0.75155200  0.35125100  0.07005600  1
  P  P11  1  0.74927500  0.84514000  0.57659900  1
  P  P12  1  0.24927500  0.15486000  0.42340100  1
  P  P13  1  0.25155200  0.64874900  0.92994400  1
  C  C14  1  0.24281000  0.66427500  0.37477700  1
  C  C15  1  0.25552400  0.17079600  0.87133700  1
  C  C16  1  0.75552400  0.82920400  0.12866300  1
  C  C17  1  0.74281000  0.33572500  0.62522300  1
  O  O18  1  0.24608000  0.06462800  0.00904600  1
  O  O19  1  0.25134400  0.55940900  0.51339900  1
  O  O20  1  0.75182800  0.85652700  0.23829400  1
  O  O21  1  0.25809300  0.81171500  0.35026500  1
  O  O22  1  0.71829600  0.36903600  0.73242100  1
  O  O23  1  0.26770200  0.31871600  0.85031900  1
  O  O24  1  0.93579200  0.26379000  0.04140800  1
  O  O25  1  0.56172500  0.25868700  0.05721300  1
  O  O26  1  0.93782700  0.75581700  0.55607800  1
  O  O27  1  0.56472800  0.74360900  0.56639200  1
  O  O28  1  0.24846500  0.14615800  0.27621800  1
  O  O29  1  0.74106200  0.01812500  0.45315500  1
  O  O30  1  0.27470900  0.64093500  0.78228800  1
  O  O31  1  0.73333200  0.52514900  0.94284800  1
  O  O32  1  0.23333200  0.47485100  0.05715200  1
  O  O33  1  0.77470900  0.35906500  0.21771200  1
  O  O34  1  0.24106200  0.98187500  0.54684500  1
  O  O35  1  0.74846500  0.85384200  0.72378200  1
  O  O36  1  0.43782700  0.24418300  0.44392200  1
  O  O37  1  0.06472800  0.25639100  0.43360800  1
  O  O38  1  0.06172500  0.74131300  0.94278700  1
  O  O39  1  0.43579200  0.73621000  0.95859200  1
  O  O40  1  0.76770200  0.68128400  0.14968100  1
  O  O41  1  0.21829600  0.63096400  0.26757900  1
  O  O42  1  0.75809300  0.18828500  0.64973500  1
  O  O43  1  0.25182800  0.14347300  0.76170600  1
  O  O44  1  0.75134400  0.44059100  0.48660100  1
  O  O45  1  0.74608000  0.93537200  0.99095400  1
