# generated using pymatgen
data_CaSnN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.12365578
_cell_length_b   7.71893672
_cell_length_c   5.61892356
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaSnN2
_chemical_formula_sum   'Ca4 Sn4 N8'
_cell_volume   265.59590512
_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
  Ca  Ca0  1  0.58296005  0.87731416  0.97744667  1.0
  Ca  Ca1  1  0.41703995  0.12268584  0.47744667  1.0
  Ca  Ca2  1  0.91703995  0.37731416  0.47744667  1.0
  Ca  Ca3  1  0.08296005  0.62268584  0.97744667  1.0
  Sn  Sn4  1  0.56941321  0.37278817  0.99421778  1.0
  Sn  Sn5  1  0.43058679  0.62721183  0.49421778  1.0
  Sn  Sn6  1  0.93058679  0.87278817  0.49421778  1.0
  Sn  Sn7  1  0.06941321  0.12721183  0.99421778  1.0
  N  N8  1  0.54805259  0.39704397  0.36161080  1.0
  N  N9  1  0.45194741  0.60295603  0.86161080  1.0
  N  N10  1  0.95194741  0.89704397  0.86161080  1.0
  N  N11  1  0.04805259  0.10295603  0.36161080  1.0
  N  N12  1  0.60032858  0.85258470  0.40772475  1.0
  N  N13  1  0.39967142  0.14741530  0.90772475  1.0
  N  N14  1  0.89967142  0.35258470  0.90772475  1.0
  N  N15  1  0.10032858  0.64741530  0.40772475  1.0