# generated using pymatgen
data_Ca7Tm(Si3Pd)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.21062828
_cell_length_b   8.21062738
_cell_length_c   8.35311208
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999575
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca7Tm(Si3Pd)4
_chemical_formula_sum   'Ca7 Tm1 Si12 Pd4'
_cell_volume   487.67634734
_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  0.50006131  0.00012162  0.25000000  1.0
  Ca  Ca1  1  0.49989124  0.99978249  0.75000000  1.0
  Ca  Ca2  1  0.99987838  0.49993869  0.25000000  1.0
  Ca  Ca3  1  0.00021751  0.50010876  0.75000000  1.0
  Ca  Ca4  1  0.50006131  0.49993869  0.25000000  1.0
  Ca  Ca5  1  0.49989124  0.50010876  0.75000000  1.0
  Ca  Ca6  1  0.00000000  0.00000000  0.25000000  1.0
  Tm  Tm7  1  0.00000000  0.00000000  0.75000000  1.0
  Si  Si8  1  0.16462089  0.32924178  0.99457329  1.0
  Si  Si9  1  0.83536447  0.67072894  0.99433070  1.0
  Si  Si10  1  0.67075822  0.83537911  0.99457329  1.0
  Si  Si11  1  0.83536447  0.67072894  0.50566930  1.0
  Si  Si12  1  0.32927106  0.16463553  0.99433070  1.0
  Si  Si13  1  0.16462089  0.32924178  0.50542671  1.0
  Si  Si14  1  0.16462089  0.83537911  0.99457329  1.0
  Si  Si15  1  0.32927106  0.16463553  0.50566930  1.0
  Si  Si16  1  0.83536447  0.16463553  0.99433070  1.0
  Si  Si17  1  0.67075822  0.83537911  0.50542671  1.0
  Si  Si18  1  0.83536447  0.16463553  0.50566930  1.0
  Si  Si19  1  0.16462089  0.83537911  0.50542671  1.0
  Pd  Pd20  1  0.33333300  0.66666700  0.00093989  1.0
  Pd  Pd21  1  0.66666700  0.33333300  0.00102085  1.0
  Pd  Pd22  1  0.66666700  0.33333300  0.49897915  1.0
  Pd  Pd23  1  0.33333300  0.66666700  0.49906011  1.0