# generated using pymatgen
data_Ti6Al16Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.29211455
_cell_length_b   8.29211240
_cell_length_c   8.29211020
_cell_angle_alpha   60.00126555
_cell_angle_beta   60.00125596
_cell_angle_gamma   60.00122854
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti6Al16Ni7
_chemical_formula_sum   'Ti6 Al16 Ni7'
_cell_volume   403.17430725
_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
  Ti  Ti0  1  0.18271068  0.81728969  0.81728957  1.0
  Ti  Ti1  1  0.81728914  0.18271036  0.18271036  1.0
  Ti  Ti2  1  0.81728883  0.18271159  0.81728856  1.0
  Ti  Ti3  1  0.81728572  0.81728604  0.18271421  1.0
  Ti  Ti4  1  0.18271131  0.81728840  0.18271134  1.0
  Ti  Ti5  1  0.18271451  0.18271424  0.81728528  1.0
  Al  Al6  1  0.83708742  0.83708769  0.83708834  1.0
  Al  Al7  1  0.83708642  0.83708676  0.48874326  1.0
  Al  Al8  1  0.48874280  0.83708760  0.83708680  1.0
  Al  Al9  1  0.83708683  0.48874355  0.83708667  1.0
  Al  Al10  1  0.16291263  0.16291231  0.16291174  1.0
  Al  Al11  1  0.16291372  0.16291324  0.51125642  1.0
  Al  Al12  1  0.16291307  0.51125671  0.16291319  1.0
  Al  Al13  1  0.51125708  0.16291263  0.16291305  1.0
  Al  Al14  1  0.61903601  0.61903563  0.61903479  1.0
  Al  Al15  1  0.61903652  0.61903688  0.14289129  1.0
  Al  Al16  1  0.14289094  0.61903569  0.61903630  1.0
  Al  Al17  1  0.61903617  0.14289117  0.61903675  1.0
  Al  Al18  1  0.38096401  0.38096425  0.38096523  1.0
  Al  Al19  1  0.38096308  0.38096315  0.85710865  1.0
  Al  Al20  1  0.38096411  0.85710872  0.38096311  1.0
  Al  Al21  1  0.85710892  0.38096451  0.38096349  1.0
  Ni  Ni22  1  0.00000008  0.49999980  0.50000006  1.0
  Ni  Ni23  1  0.50000026  0.00000018  -0.00000027  1.0
  Ni  Ni24  1  0.50000015  0.00000002  0.49999997  1.0
  Ni  Ni25  1  0.49999979  0.50000008  -0.00000015  1.0
  Ni  Ni26  1  -0.00000019  0.50000025  0.00000001  1.0
  Ni  Ni27  1  0.00000009  -0.00000018  0.50000000  1.0
  Ni  Ni28  1  0.49999987  0.50000005  0.49999998  1.0