# generated using pymatgen
data_Ca13Sm(InN4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.58209480
_cell_length_b   12.06152486
_cell_length_c   11.61343350
_cell_angle_alpha   89.98040414
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca13Sm(InN4)2
_chemical_formula_sum   'Ca13 Sm1 In2 N8'
_cell_volume   501.76446800
_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  0.50017323  0.67107756  0.23790345  1.0
  Ca  Ca1  1  0.50017323  0.32892244  0.76209655  1.0
  Ca  Ca2  1  0.50002548  0.17128297  0.26516193  1.0
  Ca  Ca3  1  0.50002548  0.82871703  0.73483807  1.0
  Ca  Ca4  1  0.50007546  0.00000000  0.50000000  1.0
  Ca  Ca5  1  0.00003770  0.93105978  0.26464501  1.0
  Ca  Ca6  1  0.00003770  0.06894022  0.73535499  1.0
  Ca  Ca7  1  0.99996624  0.42696959  0.24131078  1.0
  Ca  Ca8  1  0.99996624  0.57303041  0.75868922  1.0
  Ca  Ca9  1  0.00008797  0.76586058  0.47685963  1.0
  Ca  Ca10  1  0.00008797  0.23413942  0.52314037  1.0
  Ca  Ca11  1  0.99997817  0.25958676  0.02357953  1.0
  Ca  Ca12  1  0.99997817  0.74041324  0.97642047  1.0
  Sm  Sm13  1  0.49978286  0.50000000  0.00000000  1.0
  In  In14  1  0.50015915  0.50000000  0.50000000  1.0
  In  In15  1  0.49884034  0.00000000  0.00000000  1.0
  N  N16  1  0.00022058  0.59626504  0.12185872  1.0
  N  N17  1  0.00022058  0.40373496  0.87814128  1.0
  N  N18  1  0.00003611  0.10282203  0.37135252  1.0
  N  N19  1  0.00003611  0.89717797  0.62864748  1.0
  N  N20  1  0.50005929  0.83158906  0.35482401  1.0
  N  N21  1  0.50005929  0.16841094  0.64517599  1.0
  N  N22  1  0.49998531  0.33755454  0.13852715  1.0
  N  N23  1  0.49998531  0.66244546  0.86147285  1.0