# generated using pymatgen
data_SrCaTiMnO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.88533751
_cell_length_b   7.74191628
_cell_length_c   7.73573000
_cell_angle_alpha   89.99965695
_cell_angle_beta   89.99932040
_cell_angle_gamma   89.99935761
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCaTiMnO6
_chemical_formula_sum   'Sr2 Ca2 Ti2 Mn2 O12'
_cell_volume   232.69043125
_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  0.50000600  0.25117100  0.25001600  1.0
  Sr  Sr1  1  0.50000700  0.25117000  0.74999100  1.0
  Ca  Ca2  1  0.49999900  0.73590200  0.24998200  1.0
  Ca  Ca3  1  0.50000000  0.73590200  0.75001800  1.0
  Ti  Ti4  1  0.00000200  0.99068600  0.00000100  1.0
  Ti  Ti5  1  0.99999900  0.99073700  0.50000200  1.0
  Mn  Mn6  1  0.99999600  0.49941300  0.50000200  1.0
  Mn  Mn7  1  0.00000200  0.49937500  0.00000300  1.0
  O  O8  1  0.99999700  0.25701400  0.99999800  1.0
  O  O9  1  0.99999900  0.25702900  0.50000400  1.0
  O  O10  1  0.00000400  0.74673400  0.99999600  1.0
  O  O11  1  0.99999900  0.74676700  0.49999900  1.0
  O  O12  1  0.50000100  0.99770400  0.99999500  1.0
  O  O13  1  0.50000000  0.99776100  0.49999900  1.0
  O  O14  1  0.99999400  0.99767100  0.24999900  1.0
  O  O15  1  0.99999500  0.99767100  0.74999900  1.0
  O  O16  1  0.50000400  0.51361300  0.99999500  1.0
  O  O17  1  0.50000100  0.51360300  0.50000000  1.0
  O  O18  1  0.99999600  0.51003700  0.24999700  1.0
  O  O19  1  0.99999600  0.51003900  0.75000500  1.0