# generated using pymatgen
data_SrCaTiMnO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.75133777
_cell_length_b   7.75133777
_cell_length_c   7.74978900
_cell_angle_alpha   89.99930995
_cell_angle_beta   89.99930995
_cell_angle_gamma   90.00289561
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCaTiMnO6
_chemical_formula_sum   'Sr4 Ca4 Ti4 Mn4 O24'
_cell_volume   465.63241056
_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
  Sr  Sr0  1  0.75321700  0.24643000  0.24655300  1.0
  Sr  Sr1  1  0.24670100  0.24670100  0.24649200  1.0
  Sr  Sr2  1  0.24643000  0.75321700  0.24655300  1.0
  Sr  Sr3  1  0.75360100  0.75360100  0.75356400  1.0
  Ca  Ca4  1  0.75444700  0.24598900  0.75404600  1.0
  Ca  Ca5  1  0.24555600  0.24555600  0.75403300  1.0
  Ca  Ca6  1  0.75407100  0.75407100  0.24609400  1.0
  Ca  Ca7  1  0.24598900  0.75444700  0.75404600  1.0
  Ti  Ti8  1  0.50001000  0.99999300  0.50283300  1.0
  Ti  Ti9  1  0.50006100  0.50006100  0.99826800  1.0
  Ti  Ti10  1  0.99999300  0.50001000  0.50283300  1.0
  Ti  Ti11  1  0.50003700  0.50003700  0.50151900  1.0
  Mn  Mn12  1  0.99990600  0.99990600  0.99893300  1.0
  Mn  Mn13  1  0.50004900  0.99995900  0.99909400  1.0
  Mn  Mn14  1  0.99996500  0.99996500  0.50175900  1.0
  Mn  Mn15  1  0.99995900  0.50004900  0.99909400  1.0
  O  O16  1  0.99995400  0.25035000  0.99322600  1.0
  O  O17  1  0.50001200  0.24689600  0.99528000  1.0
  O  O18  1  0.99996800  0.24686200  0.50460000  1.0
  O  O19  1  0.50002300  0.24917300  0.50375400  1.0
  O  O20  1  0.00008200  0.74967900  0.99919700  1.0
  O  O21  1  0.49993500  0.75308100  0.99879600  1.0
  O  O22  1  0.00006400  0.75313200  0.50113700  1.0
  O  O23  1  0.49994400  0.75083600  0.50122700  1.0
  O  O24  1  0.99702500  0.99702500  0.25033500  1.0
  O  O25  1  0.50179000  0.99815100  0.24695800  1.0
  O  O26  1  0.00289900  0.00289900  0.74957100  1.0
  O  O27  1  0.49835300  0.00167000  0.75316900  1.0
  O  O28  1  0.99815100  0.50179000  0.24695800  1.0
  O  O29  1  0.50132800  0.50132800  0.24898800  1.0
  O  O30  1  0.00167000  0.49835300  0.75316900  1.0
  O  O31  1  0.49880100  0.49880100  0.75070600  1.0
  O  O32  1  0.74967900  0.00008200  0.99919700  1.0
  O  O33  1  0.25035000  0.99995400  0.99322600  1.0
  O  O34  1  0.75313200  0.00006400  0.50113700  1.0
  O  O35  1  0.24686200  0.99996800  0.50460000  1.0
  O  O36  1  0.75308100  0.49993500  0.99879600  1.0
  O  O37  1  0.24689600  0.50001200  0.99528000  1.0
  O  O38  1  0.75083600  0.49994400  0.50122700  1.0
  O  O39  1  0.24917300  0.50002300  0.50375400  1.0