# generated using pymatgen
data_MnSO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33487047
_cell_length_b   5.33487047
_cell_length_c   7.42354818
_cell_angle_alpha   70.01201451
_cell_angle_beta   109.98798549
_cell_angle_gamma   80.39134330
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnSO5
_chemical_formula_sum   'Mn2 S2 O10'
_cell_volume   176.69994424
_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
  Mn  Mn0  1  0.00000000  0.50000000  0.50000000  1.0
  Mn  Mn1  1  0.50000000  0.00000000  0.00000000  1.0
  S  S2  1  0.91448500  0.91448500  0.75000000  1.0
  S  S3  1  0.08551500  0.08551500  0.25000000  1.0
  O  O4  1  0.32506900  0.32506900  0.75000000  1.0
  O  O5  1  0.67493100  0.67493100  0.25000000  1.0
  O  O6  1  0.22674300  0.80829100  0.87472000  1.0
  O  O7  1  0.80829100  0.22674300  0.62528000  1.0
  O  O8  1  0.77325700  0.19170900  0.12528000  1.0
  O  O9  1  0.19170900  0.77325700  0.37472000  1.0
  O  O10  1  0.83667800  0.77758200  0.60464100  1.0
  O  O11  1  0.77758200  0.83667800  0.89535900  1.0
  O  O12  1  0.16332200  0.22241800  0.39535900  1.0
  O  O13  1  0.22241800  0.16332200  0.10464100  1.0