# generated using pymatgen
data_Ca4ReTc3B16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.53647031
_cell_length_b   6.01479913
_cell_length_c   11.63827932
_cell_angle_alpha   89.93321978
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4ReTc3B16
_chemical_formula_sum   'Ca4 Re1 Tc3 B16'
_cell_volume   247.55951593
_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  0.50000000  0.37300014  0.15127075  1.0
  Ca  Ca1  1  0.50000000  0.62624918  0.84852343  1.0
  Ca  Ca2  1  0.50000000  0.12557574  0.65081553  1.0
  Ca  Ca3  1  0.50000000  0.87459335  0.34979830  1.0
  Re  Re4  1  0.50000000  0.87219419  0.08232348  1.0
  Tc  Tc5  1  0.50000000  0.37334557  0.41794785  1.0
  Tc  Tc6  1  0.50000000  0.62653565  0.58240625  1.0
  Tc  Tc7  1  0.50000000  0.12750168  0.91758697  1.0
  B  B8  1  0.00000000  0.11514837  0.04731308  1.0
  B  B9  1  0.00000000  0.88579156  0.95204757  1.0
  B  B10  1  0.00000000  0.38628041  0.54727133  1.0
  B  B11  1  0.00000000  0.61404327  0.45277424  1.0
  B  B12  1  0.00000000  0.13547184  0.46768475  1.0
  B  B13  1  0.00000000  0.86459402  0.53243189  1.0
  B  B14  1  0.00000000  0.36466307  0.96737684  1.0
  B  B15  1  0.00000000  0.63423952  0.03150271  1.0
  B  B16  1  0.00000000  0.02545944  0.19275040  1.0
  B  B17  1  0.00000000  0.97609210  0.80728678  1.0
  B  B18  1  0.00000000  0.47632607  0.69227486  1.0
  B  B19  1  0.00000000  0.52347242  0.30797476  1.0
  B  B20  1  0.00000000  0.21711041  0.31602385  1.0
  B  B21  1  0.00000000  0.78333336  0.68422330  1.0
  B  B22  1  0.00000000  0.28315848  0.81548572  1.0
  B  B23  1  0.00000000  0.71582213  0.18490335  1.0