# generated using pymatgen
data_Ca7Sn6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.93694600
_cell_length_b   8.50655000
_cell_length_c   23.90688000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca7Sn6
_chemical_formula_sum   'Ca28 Sn24'
_cell_volume   1614.09757938
_cell_formula_units_Z   4
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  0.99674300  0.67478900  0.66358600  1.0
  Ca  Ca1  1  0.49674300  0.82521100  0.83641400  1.0
  Ca  Ca2  1  0.50325700  0.17478900  0.33641400  1.0
  Ca  Ca3  1  0.00325700  0.32521100  0.16358600  1.0
  Ca  Ca4  1  0.00325700  0.32521100  0.33641400  1.0
  Ca  Ca5  1  0.50325700  0.17478900  0.16358600  1.0
  Ca  Ca6  1  0.49674300  0.82521100  0.66358600  1.0
  Ca  Ca7  1  0.99674300  0.67478900  0.83641400  1.0
  Ca  Ca8  1  0.82857300  0.17975000  0.64748200  1.0
  Ca  Ca9  1  0.32857300  0.32025000  0.85251800  1.0
  Ca  Ca10  1  0.67142700  0.67975000  0.35251800  1.0
  Ca  Ca11  1  0.17142700  0.82025000  0.14748200  1.0
  Ca  Ca12  1  0.17142700  0.82025000  0.35251800  1.0
  Ca  Ca13  1  0.67142700  0.67975000  0.14748200  1.0
  Ca  Ca14  1  0.32857300  0.32025000  0.64748200  1.0
  Ca  Ca15  1  0.82857300  0.17975000  0.85251800  1.0
  Ca  Ca16  1  0.66956800  0.32584400  0.02151800  1.0
  Ca  Ca17  1  0.16956800  0.17415600  0.47848200  1.0
  Ca  Ca18  1  0.83043200  0.82584400  0.97848200  1.0
  Ca  Ca19  1  0.33043200  0.67415600  0.52151800  1.0
  Ca  Ca20  1  0.33043200  0.67415600  0.97848200  1.0
  Ca  Ca21  1  0.83043200  0.82584400  0.52151800  1.0
  Ca  Ca22  1  0.16956800  0.17415600  0.02151800  1.0
  Ca  Ca23  1  0.66956800  0.32584400  0.47848200  1.0
  Ca  Ca24  1  0.66581800  0.49376400  0.75000000  1.0
  Ca  Ca25  1  0.16581800  0.00623600  0.75000000  1.0
  Ca  Ca26  1  0.83418200  0.99376400  0.25000000  1.0
  Ca  Ca27  1  0.33418200  0.50623600  0.25000000  1.0
  Sn  Sn28  1  0.00027900  0.44453800  0.55812400  1.0
  Sn  Sn29  1  0.50027900  0.05546200  0.94187600  1.0
  Sn  Sn30  1  0.49972100  0.94453800  0.44187600  1.0
  Sn  Sn31  1  0.99972100  0.55546200  0.05812400  1.0
  Sn  Sn32  1  0.99972100  0.55546200  0.44187600  1.0
  Sn  Sn33  1  0.49972100  0.94453800  0.05812400  1.0
  Sn  Sn34  1  0.50027900  0.05546200  0.55812400  1.0
  Sn  Sn35  1  0.00027900  0.44453800  0.94187600  1.0
  Sn  Sn36  1  0.84141300  0.02483200  0.09914300  1.0
  Sn  Sn37  1  0.34141300  0.47516800  0.40085700  1.0
  Sn  Sn38  1  0.65858700  0.52483200  0.90085700  1.0
  Sn  Sn39  1  0.15858700  0.97516800  0.59914300  1.0
  Sn  Sn40  1  0.15858700  0.97516800  0.90085700  1.0
  Sn  Sn41  1  0.65858700  0.52483200  0.59914300  1.0
  Sn  Sn42  1  0.34141300  0.47516800  0.09914300  1.0
  Sn  Sn43  1  0.84141300  0.02483200  0.40085700  1.0
  Sn  Sn44  1  0.79313000  0.88672600  0.75000000  1.0
  Sn  Sn45  1  0.29313000  0.61327400  0.75000000  1.0
  Sn  Sn46  1  0.70687000  0.38672600  0.25000000  1.0
  Sn  Sn47  1  0.20687000  0.11327400  0.25000000  1.0
  Sn  Sn48  1  0.54190800  0.13528600  0.75000000  1.0
  Sn  Sn49  1  0.04190800  0.36471400  0.75000000  1.0
  Sn  Sn50  1  0.95809200  0.63528600  0.25000000  1.0
  Sn  Sn51  1  0.45809200  0.86471400  0.25000000  1.0