# generated using pymatgen
data_Ca3Ho(ReN3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.30522807
_cell_length_b   7.30522674
_cell_length_c   6.20028599
_cell_angle_alpha   74.92795129
_cell_angle_beta   74.92795899
_cell_angle_gamma   83.85353789
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Ho(ReN3)4
_chemical_formula_sum   'Ca3 Ho1 Re4 N12'
_cell_volume   308.23661322
_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  0.30165324  0.69834676  0.75000000  1.0
  Ca  Ca1  1  0.08686139  0.91313861  0.25000000  1.0
  Ca  Ca2  1  0.69943391  0.30056609  0.25000000  1.0
  Ho  Ho3  1  0.91096701  0.08903299  0.75000000  1.0
  Re  Re4  1  0.62150108  0.79903947  0.26070082  1.0
  Re  Re5  1  0.20096053  0.37849892  0.23929918  1.0
  Re  Re6  1  0.37990575  0.20187019  0.73508528  1.0
  Re  Re7  1  0.79812981  0.62009425  0.76491472  1.0
  N  N8  1  0.35208449  0.34404410  0.95597593  1.0
  N  N9  1  0.00642937  0.22302519  0.35470928  1.0
  N  N10  1  0.77697481  0.99357063  0.14529072  1.0
  N  N11  1  0.21809922  0.01409161  0.83472669  1.0
  N  N12  1  0.64327954  0.64703182  0.04769048  1.0
  N  N13  1  0.88673981  0.38219270  0.82775562  1.0
  N  N14  1  0.11782485  0.61348559  0.16553599  1.0
  N  N15  1  0.98590839  0.78190078  0.66527331  1.0
  N  N16  1  0.38651441  0.88217515  0.33446401  1.0
  N  N17  1  0.65595590  0.64791551  0.54402407  1.0
  N  N18  1  0.61780730  0.11326019  0.67224438  1.0
  N  N19  1  0.35296818  0.35672046  0.45230952  1.0