# generated using pymatgen
data_CaYb5(TcH7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05546683
_cell_length_b   5.05546695
_cell_length_c   11.98455912
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999293
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaYb5(TcH7)2
_chemical_formula_sum   'Ca1 Yb5 Tc2 H14'
_cell_volume   265.26213813
_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  0.00000000  0.00000000  0.75000000  1.0
  Yb  Yb1  1  0.00000000  0.00000000  0.25000000  1.0
  Yb  Yb2  1  0.33333300  0.66666700  0.43670593  1.0
  Yb  Yb3  1  0.66666700  0.33333300  0.56140609  1.0
  Yb  Yb4  1  0.66666700  0.33333300  0.93859391  1.0
  Yb  Yb5  1  0.33333300  0.66666700  0.06329407  1.0
  Tc  Tc6  1  0.00000000  0.00000000  0.49883163  1.0
  Tc  Tc7  1  0.00000000  0.00000000  0.00116837  1.0
  H  H8  1  0.33333300  0.66666700  0.25000000  1.0
  H  H9  1  0.66666700  0.33333300  0.75000000  1.0
  H  H10  1  0.16277394  0.83722606  0.91196581  1.0
  H  H11  1  0.16277394  0.32554887  0.91196581  1.0
  H  H12  1  0.67445113  0.83722606  0.91196581  1.0
  H  H13  1  0.83747430  0.16252570  0.09044641  1.0
  H  H14  1  0.83747430  0.67494860  0.09044641  1.0
  H  H15  1  0.32505140  0.16252570  0.09044641  1.0
  H  H16  1  0.83747430  0.16252570  0.40955359  1.0
  H  H17  1  0.83747430  0.67494860  0.40955359  1.0
  H  H18  1  0.32505140  0.16252570  0.40955359  1.0
  H  H19  1  0.16277394  0.83722606  0.58803419  1.0
  H  H20  1  0.16277394  0.32554887  0.58803419  1.0
  H  H21  1  0.67445113  0.83722606  0.58803419  1.0