# generated using pymatgen
data_Ca6Cu2Sn7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.58270435
_cell_length_b   7.45900617
_cell_length_c   12.37547500
_cell_angle_alpha   93.68924073
_cell_angle_beta   90.02378772
_cell_angle_gamma   108.02330945
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca6Cu2Sn7
_chemical_formula_sum   'Ca6 Cu2 Sn7'
_cell_volume   401.34053330
_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  0.53881444  0.07837194  0.70126967  1.0
  Ca  Ca1  1  0.19572131  0.39193572  0.29431779  1.0
  Ca  Ca2  1  0.80427869  0.60806428  0.70568221  1.0
  Ca  Ca3  1  0.63708271  0.27353148  0.00145976  1.0
  Ca  Ca4  1  0.46118556  0.92162806  0.29873033  1.0
  Ca  Ca5  1  0.36291729  0.72646852  0.99854024  1.0
  Cu  Cu6  1  0.83123524  0.65985162  0.38954465  1.0
  Cu  Cu7  1  0.16876476  0.34014838  0.61045535  1.0
  Sn  Sn8  1  0.65940182  0.31890294  0.48170465  1.0
  Sn  Sn9  1  0.81745193  0.63480679  0.17663678  1.0
  Sn  Sn10  1  0.01084824  0.02150115  0.11778209  1.0
  Sn  Sn11  1  0.18254807  0.36519321  0.82336322  1.0
  Sn  Sn12  1  -0.00000000  -0.00000000  0.50000000  1.0
  Sn  Sn13  1  0.98915176  0.97849885  0.88221791  1.0
  Sn  Sn14  1  0.34059818  0.68109706  0.51829535  1.0