# generated using pymatgen
data_CaFeSiO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52451649
_cell_length_b   6.97685460
_cell_length_c   8.85695596
_cell_angle_alpha   89.83349222
_cell_angle_beta   143.31596371
_cell_angle_gamma   76.18791083
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaFeSiO5
_chemical_formula_sum   'Ca2 Fe2 Si2 O10'
_cell_volume   186.59847720
_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
  Ca  Ca0  1  0.49885200  0.24684700  0.16983300  1.0
  Ca  Ca1  1  0.49403500  0.74464000  0.82830700  1.0
  Fe  Fe2  1  0.49637900  0.49588600  0.49915600  1.0
  Fe  Fe3  1  0.49659400  0.99582500  0.49922700  1.0
  Si  Si4  1  0.49716500  0.24552200  0.81782200  1.0
  Si  Si5  1  0.49574900  0.74627500  0.18043000  1.0
  O  O6  1  0.29346900  0.10928000  0.61303400  1.0
  O  O7  1  0.70383300  0.38027800  0.81690200  1.0
  O  O8  1  0.69939800  0.88259100  0.38517800  1.0
  O  O9  1  0.28917700  0.61146800  0.18132700  1.0
  O  O10  1  0.86344300  0.58484700  0.24620900  1.0
  O  O11  1  0.12766800  0.90609600  0.87644400  1.0
  O  O12  1  0.12962000  0.40707400  0.75205400  1.0
  O  O13  1  0.86546500  0.08577500  0.12183400  1.0
  O  O14  1  0.49687700  0.74532000  0.56938500  1.0
  O  O15  1  0.49627400  0.24643900  0.42886400  1.0