# generated using pymatgen
data_Cr2Se3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.35112245
_cell_length_b   6.35112245
_cell_length_c   11.75288941
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2Se3
_chemical_formula_sum   'Cr8 Se12'
_cell_volume   410.55963956
_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
  Cr  Cr0  1  0.66666700  0.33333300  0.75000000  1
  Cr  Cr1  1  0.33333300  0.66666700  0.25000000  1
  Cr  Cr2  1  0.00000000  0.00000000  0.00000000  1
  Cr  Cr3  1  0.00000000  0.00000000  0.50000000  1
  Cr  Cr4  1  0.66666700  0.33333300  0.01178800  1
  Cr  Cr5  1  0.33333300  0.66666700  0.51178800  1
  Cr  Cr6  1  0.33333300  0.66666700  0.98821200  1
  Cr  Cr7  1  0.66666700  0.33333300  0.48821200  1
  Se  Se8  1  0.67325500  0.66105300  0.62010700  1
  Se  Se9  1  0.98779900  0.32674500  0.62010700  1
  Se  Se10  1  0.33894700  0.01220100  0.62010700  1
  Se  Se11  1  0.01220100  0.33894700  0.12010700  1
  Se  Se12  1  0.32674500  0.98779900  0.12010700  1
  Se  Se13  1  0.66105300  0.67325500  0.12010700  1
  Se  Se14  1  0.32674500  0.33894700  0.37989300  1
  Se  Se15  1  0.01220100  0.67325500  0.37989300  1
  Se  Se16  1  0.66105300  0.98779900  0.37989300  1
  Se  Se17  1  0.98779900  0.66105300  0.87989300  1
  Se  Se18  1  0.67325500  0.01220100  0.87989300  1
  Se  Se19  1  0.33894700  0.32674500  0.87989300  1
