data_SrTaNO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.73
_cell_length_b   5.73
_cell_length_c   8.19
_cell_angle_alpha   90.15
_cell_angle_beta   90.15
_cell_angle_gamma   88.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTaNO2
_chemical_formula_sum   'Sr4 Ta4 N4 O8'
_cell_volume   269.16
_cell_formula_units_Z   4
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
  Sr  Sr0  1  0.13  0.0  0.05  1.0
  Sr  Sr1  1  0.04  0.02  0.05  1.0
  Sr  Sr2  1  0.11  0.02  0.14  1.0
  Sr  Sr3  1  0.02  0.0  0.14  1.0
  Ta  Ta4  1  0.1  1.0  0.03  1.0
  Ta  Ta5  1  0.07  0.02  0.08  1.0
  Ta  Ta6  1  0.08  0.02  0.12  1.0
  Ta  Ta7  1  0.05  1.0  0.16  1.0
  N  N8  1  0.09  0.18  0.0  1.0
  N  N9  1  0.1  0.17  0.14  1.0
  N  N10  1  0.05  0.17  0.05  1.0
  N  N11  1  0.08  0.81  0.1  1.0
  O  O12  1  0.08  0.21  0.1  1.0
  O  O13  1  0.06  0.8  0.05  1.0
  O  O14  1  0.09  0.8  0.14  1.0
  O  O15  1  0.93  0.99  0.2  1.0
  O  O16  1  0.24  0.0  0.29  1.0
  O  O17  1  0.92  0.0  0.9  1.0
  O  O18  1  0.22  0.99  0.99  1.0
  O  O19  1  0.09  0.77  0.0  1.0

data_SrTaNO2
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.73
_cell_length_b   5.73
_cell_length_c   8.19
_cell_angle_alpha   89.85
_cell_angle_beta   89.85
_cell_angle_gamma   88.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTaNO2
_chemical_formula_sum   'Sr4 Ta4 N4 O8'
_cell_volume   269.16
_cell_formula_units_Z   4
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
  Sr  Sr0  1  0.87  1.0  0.05  1.0
  Sr  Sr1  1  0.89  0.98  0.14  1.0
  Sr  Sr2  1  0.96  0.98  0.05  1.0
  Sr  Sr3  1  0.98  1.0  0.14  1.0
  Ta  Ta4  1  0.9  0.0  0.03  1.0
  Ta  Ta5  1  0.92  0.98  0.12  1.0
  Ta  Ta6  1  0.93  0.98  0.08  1.0
  Ta  Ta7  1  0.95  0.0  0.16  1.0
  N  N8  1  0.9  0.83  0.14  1.0
  N  N9  1  0.91  0.82  -0.0  1.0
  N  N10  1  0.92  0.19  0.1  1.0
  N  N11  1  0.95  0.83  0.05  1.0
  O  O12  1  0.07  0.01  0.2  1.0
  O  O13  1  0.08  1.0  0.9  1.0
  O  O14  1  0.76  1.0  0.29  1.0
  O  O15  1  0.78  0.01  0.99  1.0
  O  O16  1  0.91  0.2  0.14  1.0
  O  O17  1  0.91  0.23  -0.0  1.0
  O  O18  1  0.92  0.79  0.1  1.0
  O  O19  1  0.94  0.2  0.05  1.0

Sr Sr Sr Sr Ta Ta Ta Ta N N N N O O O O O O O O