# generated using pymatgen
data_Sr2Ca2Mn3FeO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.68507100
_cell_length_b   7.73595800
_cell_length_c   7.73773010
_cell_angle_alpha   89.99081814
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2Ca2Mn3FeO12
_chemical_formula_sum   'Sr4 Ca4 Mn6 Fe2 O24'
_cell_volume   460.01877673
_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
  Sr  Sr0  1  0.50000000  0.74958400  0.25036300  1.0
  Sr  Sr1  1  0.00000000  0.74969200  0.25034100  1.0
  Sr  Sr2  1  0.00000000  0.25034000  0.25035800  1.0
  Sr  Sr3  1  0.50000000  0.25033200  0.74965900  1.0
  Ca  Ca4  1  0.50000000  0.74954000  0.74953500  1.0
  Ca  Ca5  1  0.00000000  0.74943600  0.74951500  1.0
  Ca  Ca6  1  0.50000000  0.25052100  0.25049300  1.0
  Ca  Ca7  1  0.00000000  0.25055100  0.74954500  1.0
  Mn  Mn8  1  0.25002400  0.00002900  0.50089700  1.0
  Mn  Mn9  1  0.74997600  0.00002900  0.50089700  1.0
  Mn  Mn10  1  0.25003400  0.49994900  0.99889000  1.0
  Mn  Mn11  1  0.74996600  0.49994900  0.99889000  1.0
  Mn  Mn12  1  0.25004100  0.49994900  0.50100100  1.0
  Mn  Mn13  1  0.74995900  0.49994900  0.50100100  1.0
  Fe  Fe14  1  0.25002700  0.00003300  0.99876000  1.0
  Fe  Fe15  1  0.74997300  0.00003300  0.99876000  1.0
  O  O16  1  0.25002100  0.74627600  0.99520500  1.0
  O  O17  1  0.74997900  0.74627600  0.99520500  1.0
  O  O18  1  0.25001200  0.74938800  0.50527100  1.0
  O  O19  1  0.74998800  0.74938800  0.50527100  1.0
  O  O20  1  0.24996300  0.25374400  0.99928400  1.0
  O  O21  1  0.75003700  0.25374400  0.99928400  1.0
  O  O22  1  0.24997600  0.25061800  0.50046700  1.0
  O  O23  1  0.75002400  0.25061800  0.50046700  1.0
  O  O24  1  0.25201000  0.00208800  0.25381000  1.0
  O  O25  1  0.74799000  0.00208800  0.25381000  1.0
  O  O26  1  0.24807300  0.99798700  0.74624000  1.0
  O  O27  1  0.75192700  0.99798700  0.74624000  1.0
  O  O28  1  0.25244400  0.49756300  0.25062900  1.0
  O  O29  1  0.74755600  0.49756300  0.25062900  1.0
  O  O30  1  0.24758900  0.50237600  0.74938000  1.0
  O  O31  1  0.75241100  0.50237600  0.74938000  1.0
  O  O32  1  0.50000000  0.99996300  0.99925600  1.0
  O  O33  1  0.00000000  0.00002000  0.99551600  1.0
  O  O34  1  0.50000000  0.99997300  0.50067300  1.0
  O  O35  1  0.00000000  0.00003000  0.50496100  1.0
  O  O36  1  0.50000000  0.50002300  0.99964200  1.0
  O  O37  1  0.00000000  0.49998100  0.99489700  1.0
  O  O38  1  0.50000000  0.50001800  0.50035600  1.0
  O  O39  1  0.00000000  0.49997600  0.50519800  1.0