# generated using pymatgen
data_Ca5Si3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.65380066
_cell_length_b   7.65385975
_cell_length_c   9.15811823
_cell_angle_alpha   114.69969818
_cell_angle_beta   114.69983282
_cell_angle_gamma   90.00426324
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca5Si3
_chemical_formula_sum   'Ca10 Si6'
_cell_volume   432.78526238
_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  0.18040255  0.04155965  0.72197674  1.0
  Ca  Ca1  1  0.04161094  0.54160542  0.72195314  1.0
  Ca  Ca2  1  0.68031770  0.18032236  0.72208263  1.0
  Ca  Ca3  1  0.95838906  0.45839458  0.27804686  1.0
  Ca  Ca4  1  0.54168696  0.68039654  0.72209172  1.0
  Ca  Ca5  1  0.81959745  0.95844035  0.27802326  1.0
  Ca  Ca6  1  0.45831304  0.31960346  0.27790828  1.0
  Ca  Ca7  1  0.31968230  0.81967764  0.27791737  1.0
  Ca  Ca8  1  0.50000000  0.50000000  0.00000000  1.0
  Ca  Ca9  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si10  1  0.61226274  0.11226211  0.00025265  1.0
  Si  Si11  1  0.88798000  0.61219713  0.00017183  1.0
  Si  Si12  1  0.11202000  0.38780287  0.99982817  1.0
  Si  Si13  1  0.38773726  0.88773789  0.99974735  1.0
  Si  Si14  1  0.74982159  0.75003754  0.50000580  1.0
  Si  Si15  1  0.25017841  0.24996246  0.49999420  1.0