# generated using pymatgen
data_CaNd(Al5Os)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84461099
_cell_length_b   6.84461124
_cell_length_c   9.13046679
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.74897295
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaNd(Al5Os)4
_chemical_formula_sum   'Ca1 Nd1 Al20 Os4'
_cell_volume   424.78644110
_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  0.87314491  0.12685509  0.75000000  1.0
  Nd  Nd1  1  0.12494727  0.87505273  0.25000000  1.0
  Al  Al2  1  0.62276234  0.37723766  0.54024744  1.0
  Al  Al3  1  0.37718530  0.62281470  0.44810487  1.0
  Al  Al4  1  0.37718530  0.62281470  0.05189513  1.0
  Al  Al5  1  0.62276234  0.37723766  0.95975256  1.0
  Al  Al6  1  0.22473947  0.22596985  0.50088246  1.0
  Al  Al7  1  0.77403015  0.77526053  0.50088246  1.0
  Al  Al8  1  0.77403015  0.77526053  0.99911754  1.0
  Al  Al9  1  0.22473947  0.22596985  0.99911754  1.0
  Al  Al10  1  0.84310148  0.15689852  0.09951153  1.0
  Al  Al11  1  0.16107199  0.83892801  0.89807403  1.0
  Al  Al12  1  0.16107199  0.83892801  0.60192597  1.0
  Al  Al13  1  0.84310148  0.15689852  0.40048847  1.0
  Al  Al14  1  0.85736285  0.59006270  0.75000000  1.0
  Al  Al15  1  0.13994100  0.40907747  0.25000000  1.0
  Al  Al16  1  0.40993730  0.14263715  0.75000000  1.0
  Al  Al17  1  0.59092253  0.86005900  0.25000000  1.0
  Al  Al18  1  0.21567845  0.47822354  0.75000000  1.0
  Al  Al19  1  0.78047718  0.51784042  0.25000000  1.0
  Al  Al20  1  0.52177646  0.78432155  0.75000000  1.0
  Al  Al21  1  0.48215958  0.21952282  0.25000000  1.0
  Os  Os22  1  0.99914329  0.50020830  0.50106915  1.0
  Os  Os23  1  0.99914329  0.50020830  0.99893085  1.0
  Os  Os24  1  0.49979170  0.00085671  0.99893085  1.0
  Os  Os25  1  0.49979170  0.00085671  0.50106915  1.0