# generated using pymatgen
data_NdSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19823149
_cell_length_b   8.43315715
_cell_length_c   8.52330929
_cell_angle_alpha   89.84593445
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdSe2
_chemical_formula_sum   'Nd4 Se8'
_cell_volume   301.76109939
_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
  Nd  Nd0  1  0.27912128  0.37325823  0.27489643  1.0
  Nd  Nd1  1  0.72087872  0.62674177  0.72510357  1.0
  Nd  Nd2  1  0.22087872  0.87325823  0.27489643  1.0
  Nd  Nd3  1  0.77912128  0.12674177  0.72510357  1.0
  Se  Se4  1  0.18021699  0.61738460  0.99774061  1.0
  Se  Se5  1  0.75657046  0.12521032  0.36805291  1.0
  Se  Se6  1  0.24342954  0.87478968  0.63194709  1.0
  Se  Se7  1  0.25657046  0.37478968  0.63194709  1.0
  Se  Se8  1  0.68021699  0.88261540  0.00225939  1.0
  Se  Se9  1  0.74342954  0.62521032  0.36805291  1.0
  Se  Se10  1  0.81978301  0.38261540  0.00225939  1.0
  Se  Se11  1  0.31978301  0.11738460  0.99774061  1.0