# generated using pymatgen
data_LiFe2Si2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.99193200
_cell_length_b   5.66627000
_cell_length_c   10.43580018
_cell_angle_alpha   58.42138059
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2Si2O7
_chemical_formula_sum   'Li4 Fe8 Si8 O28'
_cell_volume   654.48063237
_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  0.72648600  0.06479700  0.12370500  1
  Li  Li1  1  0.22648600  0.93520300  0.37629500  1
  Li  Li2  1  0.77351400  0.06479700  0.62370500  1
  Li  Li3  1  0.27351400  0.93520300  0.87629500  1
  Fe  Fe4  1  0.10158700  0.53174100  0.12430400  1
  Fe  Fe5  1  0.49297500  0.15315300  0.22205200  1
  Fe  Fe6  1  0.99297500  0.84684700  0.27794800  1
  Fe  Fe7  1  0.60158700  0.46825900  0.37569600  1
  Fe  Fe8  1  0.39841300  0.53174100  0.62430400  1
  Fe  Fe9  1  0.00702500  0.15315300  0.72205200  1
  Fe  Fe10  1  0.50702500  0.84684700  0.77794800  1
  Fe  Fe11  1  0.89841300  0.46825900  0.87569600  1
  Si  Si12  1  0.88476300  0.79213400  0.02704200  1
  Si  Si13  1  0.66526600  0.63145400  0.04970800  1
  Si  Si14  1  0.16526600  0.36854600  0.45029200  1
  Si  Si15  1  0.38476300  0.20786600  0.47295800  1
  Si  Si16  1  0.61523700  0.79213400  0.52704200  1
  Si  Si17  1  0.83473400  0.63145400  0.54970800  1
  Si  Si18  1  0.33473400  0.36854600  0.95029200  1
  Si  Si19  1  0.11523700  0.20786600  0.97295800  1
  O  O20  1  0.16001000  0.91593000  0.00509500  1
  O  O21  1  0.79213200  0.58159300  0.03404800  1
  O  O22  1  0.61480300  0.32422600  0.11132900  1
  O  O23  1  0.04126700  0.19577900  0.10669100  1
  O  O24  1  0.37840700  0.14614000  0.11809700  1
  O  O25  1  0.65554400  0.73186200  0.16851500  1
  O  O26  1  0.95725700  0.64850900  0.17952900  1
  O  O27  1  0.45725700  0.35149100  0.32047100  1
  O  O28  1  0.15554400  0.26813800  0.33148500  1
  O  O29  1  0.87840700  0.85386000  0.38190300  1
  O  O30  1  0.54126700  0.80422100  0.39330900  1
  O  O31  1  0.11480300  0.67577400  0.38867100  1
  O  O32  1  0.29213200  0.41840700  0.46595200  1
  O  O33  1  0.66001000  0.08407000  0.49490500  1
  O  O34  1  0.33999000  0.91593000  0.50509500  1
  O  O35  1  0.70786800  0.58159300  0.53404800  1
  O  O36  1  0.88519700  0.32422600  0.61132900  1
  O  O37  1  0.45873300  0.19577900  0.60669100  1
  O  O38  1  0.12159300  0.14614000  0.61809700  1
  O  O39  1  0.84445600  0.73186200  0.66851500  1
  O  O40  1  0.54274300  0.64850900  0.67952900  1
  O  O41  1  0.04274300  0.35149100  0.82047100  1
  O  O42  1  0.34445600  0.26813800  0.83148500  1
  O  O43  1  0.62159300  0.85386000  0.88190300  1
  O  O44  1  0.95873300  0.80422100  0.89330900  1
  O  O45  1  0.38519700  0.67577400  0.88867100  1
  O  O46  1  0.20786800  0.41840700  0.96595200  1
  O  O47  1  0.83999000  0.08407000  0.99490500  1
