# generated using pymatgen
data_KMnCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.86265975
_cell_length_b   8.80346841
_cell_length_c   14.36243149
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KMnCl3
_chemical_formula_sum   'K4 Mn4 Cl12'
_cell_volume   488.39165468
_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
  K  K0  1  0.75000000  0.56306421  0.82478556  1.0
  K  K1  1  0.25000000  0.93693579  0.32478556  1.0
  K  K2  1  0.25000000  0.43693579  0.17521444  1.0
  K  K3  1  0.75000000  0.06306421  0.67521444  1.0
  Mn  Mn4  1  0.25000000  0.16468404  0.94477696  1.0
  Mn  Mn5  1  0.25000000  0.66468404  0.55522304  1.0
  Mn  Mn6  1  0.75000000  0.33531596  0.44477696  1.0
  Mn  Mn7  1  0.75000000  0.83531596  0.05522304  1.0
  Cl  Cl8  1  0.25000000  0.52214831  0.39989103  1.0
  Cl  Cl9  1  0.25000000  0.67297509  0.99394665  1.0
  Cl  Cl10  1  0.75000000  0.47785169  0.60010897  1.0
  Cl  Cl11  1  0.75000000  0.72071720  0.20800283  1.0
  Cl  Cl12  1  0.25000000  0.27928280  0.79199717  1.0
  Cl  Cl13  1  0.75000000  0.97785169  0.89989103  1.0
  Cl  Cl14  1  0.25000000  0.02214831  0.10010897  1.0
  Cl  Cl15  1  0.75000000  0.22071720  0.29199717  1.0
  Cl  Cl16  1  0.75000000  0.32702491  0.00605335  1.0
  Cl  Cl17  1  0.25000000  0.77928280  0.70800283  1.0
  Cl  Cl18  1  0.75000000  0.82702491  0.49394665  1.0
  Cl  Cl19  1  0.25000000  0.17297509  0.50605335  1.0