# generated using pymatgen
data_MnZnSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.12654087
_cell_length_b   4.12654087
_cell_length_c   20.15651817
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnZnSe2
_chemical_formula_sum   'Mn3 Zn3 Se6'
_cell_volume   297.24766221
_cell_formula_units_Z   3
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  0.66666700  0.33333300  0.33366200  1
  Mn  Mn1  1  0.33333300  0.66666700  0.66699500  1
  Mn  Mn2  1  0.00000000  0.00000000  0.00032900  1
  Zn  Zn3  1  0.00000000  0.00000000  0.50009900  1
  Zn  Zn4  1  0.66666700  0.33333300  0.83343200  1
  Zn  Zn5  1  0.33333300  0.66666700  0.16676600  1
  Se  Se6  1  0.66666700  0.33333300  0.45969100  1
  Se  Se7  1  0.00000000  0.00000000  0.62321500  1
  Se  Se8  1  0.33333300  0.66666700  0.79302400  1
  Se  Se9  1  0.66666700  0.33333300  0.95654800  1
  Se  Se10  1  0.00000000  0.00000000  0.12635800  1
  Se  Se11  1  0.33333300  0.66666700  0.28988100  1
