data_NpCoO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.73
_cell_length_b   5.73
_cell_length_c   5.73
_cell_angle_alpha   58.96
_cell_angle_beta   58.96
_cell_angle_gamma   58.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NpCoO3
_chemical_formula_sum   'Np2 Co2 O6'
_cell_volume   129.6
_cell_formula_units_Z   2
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
  Np  Np2  1  0.0  0.0  0.99  1.0
  Np  Np3  1  0.0  0.0  0.14  1.0
  Co  Co0  1  0.0  0.0  0.11  1.0
  Co  Co1  1  0.0  0.0  0.02  1.0
  O  O4  1  0.1  0.13  0.22  1.0
  O  O5  1  0.83  0.72  0.22  1.0
  O  O6  1  0.07  0.15  0.22  1.0
  O  O7  1  0.93  0.85  0.91  1.0
  O  O8  1  0.17  0.28  0.91  1.0
  O  O9  1  0.9  0.87  0.91  1.0

data_NpCoO3
_symmetry_space_group_name_H-M   P-1
_cell_length_a   5.64
_cell_length_b   5.64
_cell_length_c   5.73
_cell_angle_alpha   60.52
_cell_angle_beta   60.52
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   NpCoO3
_chemical_formula_sum   'Np2 Co2 O6'
_cell_volume   129.6
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Np  Np0  2  0.0  0.43  0.07  1.0
  Co  Co1  2  0.0  0.45  0.05  1.0
  O  O2  2  0.13  0.65  0.62  1.0
  O  O3  2  0.15  0.65  0.62  1.0
  O  O4  2  0.28  0.35  0.7  1.0

Np Np Co Co O O O O O O