# generated using pymatgen
data_Ca18YbIn8N7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.38357312
_cell_length_b   10.38358625
_cell_length_c   10.38353064
_cell_angle_alpha   59.99991283
_cell_angle_beta   59.99994607
_cell_angle_gamma   60.00010229
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca18YbIn8N7
_chemical_formula_sum   'Ca18 Yb1 In8 N7'
_cell_volume   791.63342615
_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
  Ca  Ca0  1  0.17301098  0.50000000  0.82699002  1.0
  Ca  Ca1  1  0.50000100  0.82698902  0.17300898  1.0
  Ca  Ca2  1  0.82699102  0.17300898  0.49999900  1.0
  Ca  Ca3  1  0.16660128  0.83339972  0.16660128  1.0
  Ca  Ca4  1  0.82698902  0.50000000  0.17300998  1.0
  Ca  Ca5  1  0.17300898  0.82699102  0.50000100  1.0
  Ca  Ca6  1  0.16660028  0.16660028  0.83339872  1.0
  Ca  Ca7  1  0.17300998  0.50000000  0.49999900  1.0
  Ca  Ca8  1  0.83339972  0.83339972  0.16660128  1.0
  Ca  Ca9  1  0.83339872  0.16660028  0.83339872  1.0
  Ca  Ca10  1  0.50000100  0.82698802  0.50000000  1.0
  Ca  Ca11  1  0.50000000  0.50000000  0.17300998  1.0
  Ca  Ca12  1  0.16660128  0.83339972  0.83339772  1.0
  Ca  Ca13  1  0.49999900  0.17301098  0.82699102  1.0
  Ca  Ca14  1  0.49999900  0.17301198  0.50000000  1.0
  Ca  Ca15  1  0.82699002  0.50000000  0.50000100  1.0
  Ca  Ca16  1  0.83339872  0.16660028  0.16660228  1.0
  Ca  Ca17  1  0.50000000  0.50000000  0.82699002  1.0
  Yb  Yb18  1  0.50000000  0.50000000  0.50000000  1.0
  In  In19  1  0.17528295  0.17528195  0.47415214  1.0
  In  In20  1  0.82472105  0.52583886  0.82472005  1.0
  In  In21  1  0.47416114  0.17527895  0.17527995  1.0
  In  In22  1  0.17527895  0.47416114  0.17527995  1.0
  In  In23  1  0.52583886  0.82472105  0.82472005  1.0
  In  In24  1  0.17528095  0.17527995  0.17527995  1.0
  In  In25  1  0.82471905  0.82472005  0.82472005  1.0
  In  In26  1  0.82471705  0.82471805  0.52584786  1.0
  N  N27  1  0.67266407  0.32733593  0.67266407  1.0
  N  N28  1  0.67266407  0.32733593  0.32733593  1.0
  N  N29  1  0.32733593  0.67266407  0.67266407  1.0
  N  N30  1  0.32733593  0.67266407  0.32733593  1.0
  N  N31  1  0.32733593  0.32733693  0.67266407  1.0
  N  N32  1  0.67266407  0.67266307  0.32733593  1.0
  N  N33  1  0.00000000  0.00000000  0.00000000  1.0