# generated using pymatgen
data_CrSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.45920141
_cell_length_b   3.45920141
_cell_length_c   11.77632044
_cell_angle_alpha   85.97774094
_cell_angle_beta   85.97774094
_cell_angle_gamma   59.97270130
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrSe2
_chemical_formula_sum   'Cr1 Se2'
_cell_volume   121.60280035
_cell_formula_units_Z   1
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  0.00000000  0.00000000  -0.00000000  1.0
  Se  Se1  1  0.68672526  0.68672526  0.87295435  1.0
  Se  Se2  1  0.31327474  0.31327474  0.12704565  1.0