data_In2NiP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03
_cell_length_b   5.03
_cell_length_c   5.91
_cell_angle_alpha   112.64
_cell_angle_beta   112.64
_cell_angle_gamma   35.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2NiP
_chemical_formula_sum   'In2 Ni1 P1'
_cell_volume   79.53
_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
  In  In0  1  0.04  0.0  0.39  1.0
  In  In1  1  0.89  0.0  0.01  1.0
  Ni  Ni2  1  0.29  0.0  0.26  1.0
  P  P3  1  0.72  0.0  0.85  1.0

data_In2NiP
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.07
_cell_length_b   5.03
_cell_length_c   5.91
_cell_angle_alpha   112.64
_cell_angle_beta   90.0
_cell_angle_gamma   107.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2NiP
_chemical_formula_sum   'In2 Ni1 P1'
_cell_volume   79.53
_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
  In  In0  1  0.0  0.11  0.99  1.0
  In  In1  1  0.0  0.96  0.61  1.0
  Ni  Ni2  1  0.0  0.71  0.74  1.0
  P  P3  1  0.0  0.28  0.15  1.0

In In Ni P