# generated using pymatgen
data_Nd2C2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.39526161
_cell_length_b   7.39526169
_cell_length_c   7.09932898
_cell_angle_alpha   77.76643204
_cell_angle_beta   77.76643319
_cell_angle_gamma   32.68762572
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2C2Se
_chemical_formula_sum   'Nd4 C4 Se2'
_cell_volume   204.50780954
_cell_formula_units_Z   2
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  0.55459720  0.16357285  0.14310165  1.0
  Nd  Nd1  1  0.16357890  0.55457129  0.64309032  1.0
  Nd  Nd2  1  0.44542871  0.83642110  0.85690968  1.0
  Nd  Nd3  1  0.83642715  0.44540280  0.35689835  1.0
  C  C4  1  0.35999387  0.09309225  0.46887077  1.0
  C  C5  1  0.90690775  0.64000613  0.03112923  1.0
  C  C6  1  0.64001233  0.90688105  0.53112281  1.0
  C  C7  1  0.09311895  0.35998767  0.96887719  1.0
  Se  Se8  1  0.79235445  0.20764555  0.75000000  1.0
  Se  Se9  1  0.20758070  0.79241930  0.25000000  1.0