# generated using pymatgen
data_CaErNi12As7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31211963
_cell_length_b   9.31211992
_cell_length_c   3.78262212
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000941
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaErNi12As7
_chemical_formula_sum   'Ca1 Er1 Ni12 As7'
_cell_volume   284.06691511
_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  0.66666700  0.33333300  0.50000000  1.0
  Er  Er1  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni2  1  0.38690676  0.28481585  0.00000000  1.0
  Ni  Ni3  1  0.89790810  0.61309324  0.00000000  1.0
  Ni  Ni4  1  0.71518415  0.10209190  0.00000000  1.0
  Ni  Ni5  1  0.61274914  0.79366374  0.00000000  1.0
  Ni  Ni6  1  0.18091459  0.38725086  0.00000000  1.0
  Ni  Ni7  1  0.20633626  0.81908541  0.00000000  1.0
  Ni  Ni8  1  0.75978884  0.71812339  0.50000000  1.0
  Ni  Ni9  1  0.95833356  0.24021116  0.50000000  1.0
  Ni  Ni10  1  0.28187661  0.04166644  0.50000000  1.0
  Ni  Ni11  1  0.42808599  0.55253824  0.50000000  1.0
  Ni  Ni12  1  0.12445225  0.57191401  0.50000000  1.0
  Ni  Ni13  1  0.44746176  0.87554775  0.50000000  1.0
  As  As14  1  0.62147293  0.54983790  0.00000000  1.0
  As  As15  1  0.92836496  0.37852707  0.00000000  1.0
  As  As16  1  0.45016210  0.07163504  0.00000000  1.0
  As  As17  1  0.74095949  0.96462756  0.50000000  1.0
  As  As18  1  0.22366807  0.25904051  0.50000000  1.0
  As  As19  1  0.03537244  0.77633193  0.50000000  1.0
  As  As20  1  0.33333300  0.66666700  0.00000000  1.0