# generated using pymatgen
data_Sr6Ca2Mn5(FeO8)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.75153000
_cell_length_b   7.75680500
_cell_length_c   7.80028400
_cell_angle_alpha   89.99916998
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr6Ca2Mn5(FeO8)3
_chemical_formula_sum   'Sr6 Ca2 Mn5 Fe3 O24'
_cell_volume   469.00850806
_cell_formula_units_Z   1
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
  Sr  Sr0  1  0.25062200  0.74951900  0.25100600  1.0
  Sr  Sr1  1  0.25052300  0.25049800  0.25096400  1.0
  Sr  Sr2  1  0.74947600  0.25058800  0.25108900  1.0
  Sr  Sr3  1  0.25052300  0.74950200  0.74903600  1.0
  Sr  Sr4  1  0.25062200  0.25048100  0.74899400  1.0
  Sr  Sr5  1  0.74947600  0.74941200  0.74891100  1.0
  Ca  Ca6  1  0.74918600  0.74922900  0.25141500  1.0
  Ca  Ca7  1  0.74918600  0.25077100  0.74858500  1.0
  Mn  Mn8  1  0.50138100  0.50000000  0.00000000  1.0
  Mn  Mn9  1  0.99876900  0.00000000  0.50000000  1.0
  Mn  Mn10  1  0.99843900  0.50000000  0.50000000  1.0
  Mn  Mn11  1  0.50143900  0.00000000  0.50000000  1.0
  Mn  Mn12  1  0.50127100  0.50000000  0.50000000  1.0
  Fe  Fe13  1  0.99853800  0.00000000  0.00000000  1.0
  Fe  Fe14  1  0.99847400  0.50000000  0.00000000  1.0
  Fe  Fe15  1  0.50132600  0.00000000  0.00000000  1.0
  O  O16  1  0.99643700  0.99776000  0.25273500  1.0
  O  O17  1  0.99661900  0.50217800  0.25452100  1.0
  O  O18  1  0.50340100  0.99781700  0.25450700  1.0
  O  O19  1  0.50372700  0.50276800  0.25075700  1.0
  O  O20  1  0.99643700  0.00224000  0.74726500  1.0
  O  O21  1  0.99661900  0.49782200  0.74547900  1.0
  O  O22  1  0.50340100  0.00218300  0.74549300  1.0
  O  O23  1  0.50372700  0.49723200  0.74924300  1.0
  O  O24  1  0.24810300  0.00000000  0.00000000  1.0
  O  O25  1  0.25281600  0.50000000  0.00000000  1.0
  O  O26  1  0.75174900  0.00000000  0.00000000  1.0
  O  O27  1  0.74702100  0.50000000  0.00000000  1.0
  O  O28  1  0.24969400  0.00000000  0.50000000  1.0
  O  O29  1  0.25047400  0.50000000  0.50000000  1.0
  O  O30  1  0.75035800  0.00000000  0.50000000  1.0
  O  O31  1  0.74963100  0.50000000  0.50000000  1.0
  O  O32  1  0.99673600  0.75185700  0.00200900  1.0
  O  O33  1  0.99673600  0.24814300  0.99799100  1.0
  O  O34  1  0.50339200  0.74712300  0.00210100  1.0
  O  O35  1  0.50339200  0.25287700  0.99789900  1.0
  O  O36  1  0.99648400  0.75033600  0.49732100  1.0
  O  O37  1  0.99648400  0.24966400  0.50267900  1.0
  O  O38  1  0.50365300  0.74957400  0.49712600  1.0
  O  O39  1  0.50365300  0.25042600  0.50287400  1.0