# generated using pymatgen
data_CaYSi4Tc3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.79742065
_cell_length_b   6.64995097
_cell_length_c   6.78948260
_cell_angle_alpha   70.45511205
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaYSi4Tc3
_chemical_formula_sum   'Ca2 Y2 Si8 Tc6'
_cell_volume   289.21791050
_cell_formula_units_Z   2
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  0.16724254  0.94313589  0.18666955  1.0
  Ca  Ca1  1  0.33275746  0.44313589  0.18666955  1.0
  Y  Y2  1  0.83340284  0.05899756  0.80828393  1.0
  Y  Y3  1  0.66659716  0.55899756  0.80828393  1.0
  Si  Si4  1  0.54719777  0.11685852  0.10652055  1.0
  Si  Si5  1  0.35740355  0.63199398  0.50822487  1.0
  Si  Si6  1  0.86323646  0.86828257  0.48736063  1.0
  Si  Si7  1  0.04929523  0.38215203  0.89710413  1.0
  Si  Si8  1  0.14259645  0.13199398  0.50822487  1.0
  Si  Si9  1  0.63676354  0.36828257  0.48736063  1.0
  Si  Si10  1  0.95280223  0.61685852  0.10652055  1.0
  Si  Si11  1  0.45070477  0.88215203  0.89710413  1.0
  Tc  Tc12  1  0.84039430  0.24393871  0.23937686  1.0
  Tc  Tc13  1  0.34371558  0.25757889  0.76090540  1.0
  Tc  Tc14  1  0.15628442  0.75757889  0.76090540  1.0
  Tc  Tc15  1  0.65960570  0.74393871  0.23937686  1.0
  Tc  Tc16  1  0.50389017  0.99706186  0.50555308  1.0
  Tc  Tc17  1  0.99610983  0.49706186  0.50555308  1.0