# generated using pymatgen
data_Ca3Nd7(Pb3Cl)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.39398396
_cell_length_b   9.37819241
_cell_length_c   7.04812751
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.07381866
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Nd7(Pb3Cl)2
_chemical_formula_sum   'Ca3 Nd7 Pb6 Cl2'
_cell_volume   537.34078864
_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  0.25564593  0.00201210  0.25000000  1.0
  Ca  Ca1  1  0.74356895  0.99871783  0.75000000  1.0
  Ca  Ca2  1  0.00365720  0.25749177  0.25000000  1.0
  Nd  Nd3  1  0.99713681  0.74407192  0.75000000  1.0
  Nd  Nd4  1  0.74586948  0.74410485  0.25000000  1.0
  Nd  Nd5  1  0.25432462  0.25600677  0.75000000  1.0
  Nd  Nd6  1  0.33338461  0.66919590  0.00130357  1.0
  Nd  Nd7  1  0.66647840  0.32743207  0.00136780  1.0
  Nd  Nd8  1  0.66647840  0.32743207  0.49863220  1.0
  Nd  Nd9  1  0.33338461  0.66919590  0.49869643  1.0
  Pb  Pb10  1  0.60869979  0.99832345  0.25000000  1.0
  Pb  Pb11  1  0.38913592  0.99955179  0.75000000  1.0
  Pb  Pb12  1  0.00012426  0.60909402  0.25000000  1.0
  Pb  Pb13  1  0.00199923  0.39570858  0.75000000  1.0
  Pb  Pb14  1  0.39482915  0.39380159  0.25000000  1.0
  Pb  Pb15  1  0.60745733  0.60501158  0.75000000  1.0
  Cl  Cl16  1  0.99891416  0.00142441  0.99982271  1.0
  Cl  Cl17  1  0.99891416  0.00142441  0.50017729  1.0