data_InMoP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11
_cell_length_b   3.15
_cell_length_c   7.1
_cell_angle_alpha   90.0
_cell_angle_beta   94.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InMoP2
_chemical_formula_sum   'In1 Mo1 P2'
_cell_volume   69.14
_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  0.73  0.0  0.54  1.0
  Mo  Mo1  1  0.0  0.0  0.0  1.0
  P  P2  1  0.55  0.57  0.31  1.0
  P  P3  1  0.01  0.57  0.76  1.0

data_InMoP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.11
_cell_length_b   3.15
_cell_length_c   7.1
_cell_angle_alpha   90.0
_cell_angle_beta   94.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InMoP2
_chemical_formula_sum   'In1 Mo1 P2'
_cell_volume   69.14
_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  0.73  0.0  0.54  1.0
  Mo  Mo1  1  0.0  0.0  0.0  1.0
  P  P2  1  0.01  0.57  0.76  1.0
  P  P3  1  0.55  0.57  0.31  1.0

In Mo P P
In Mo P P 0 2 o - o 0 2 o o o 0 3 + - o 0 3 + o o 1 3 o - - 1 3 o o - 