# generated using pymatgen
data_BaMn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.05609004
_cell_length_b   5.78279135
_cell_length_c   10.82206711
_cell_angle_alpha   97.87344666
_cell_angle_beta   100.80299388
_cell_angle_gamma   90.00005564
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMn3O6
_chemical_formula_sum   'Ba2 Mn6 O12'
_cell_volume   246.90208425
_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
  Ba  Ba0  1  0.06785100  0.28436600  0.13570700  1.0
  Ba  Ba1  1  0.93214900  0.71564400  0.86429600  1.0
  Mn  Mn2  1  0.56329500  0.78221800  0.12646600  1.0
  Mn  Mn3  1  0.43670500  0.21779100  0.87353600  1.0
  Mn  Mn4  1  0.70610300  0.85261500  0.41229400  1.0
  Mn  Mn5  1  0.29389600  0.14737800  0.58770500  1.0
  Mn  Mn6  1  0.29432300  0.64822300  0.58860700  1.0
  Mn  Mn7  1  0.70567500  0.35177300  0.41139100  1.0
  O  O8  1  0.50000200  0.00000800  0.00000300  1.0
  O  O9  1  0.50000100  0.50000400  0.00000300  1.0
  O  O10  1  0.64496100  0.57454700  0.28994000  1.0
  O  O11  1  0.35503900  0.42545000  0.71005900  1.0
  O  O12  1  0.64380000  0.06505300  0.28761600  1.0
  O  O13  1  0.35620000  0.93494200  0.71238400  1.0
  O  O14  1  0.06400100  0.78121500  0.12807500  1.0
  O  O15  1  0.93599700  0.21879100  0.87192200  1.0
  O  O16  1  0.22679500  0.36123700  0.45359100  1.0
  O  O17  1  0.77320400  0.63875400  0.54640600  1.0
  O  O18  1  0.77079300  0.13513500  0.54157400  1.0
  O  O19  1  0.22920600  0.86485800  0.45842600  1.0