data_Na3CoN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.3
_cell_length_b   9.3
_cell_length_c   9.3
_cell_angle_alpha   109.47
_cell_angle_beta   109.47
_cell_angle_gamma   109.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na3CoN2
_chemical_formula_sum   'Na24 Co8 N16'
_cell_volume   619.04
_cell_formula_units_Z   8
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
  Na  Na0  1  0.21  0.4  0.32  1.0
  Na  Na1  1  0.16  0.4  0.68  1.0
  Na  Na2  1  0.21  0.34  0.31  1.0
  Na  Na3  1  0.16  0.34  0.69  1.0
  Na  Na4  1  0.34  0.31  0.21  1.0
  Na  Na5  1  0.34  0.69  0.16  1.0
  Na  Na6  1  0.4  0.32  0.21  1.0
  Na  Na7  1  0.4  0.68  0.16  1.0
  Na  Na8  1  0.69  0.16  0.34  1.0
  Na  Na9  1  0.31  0.21  0.34  1.0
  Na  Na10  1  0.68  0.16  0.4  1.0
  Na  Na11  1  0.32  0.21  0.4  1.0
  Na  Na12  1  0.16  0.97  0.05  1.0
  Na  Na13  1  0.21  0.97  0.69  1.0
  Na  Na14  1  0.16  0.03  0.06  1.0
  Na  Na15  1  0.21  0.03  0.68  1.0
  Na  Na16  1  0.03  0.06  0.16  1.0
  Na  Na17  1  0.03  0.68  0.21  1.0
  Na  Na18  1  0.97  0.05  0.16  1.0
  Na  Na19  1  0.97  0.69  0.21  1.0
  Na  Na20  1  0.68  0.21  0.03  1.0
  Na  Na21  1  0.06  0.16  0.03  1.0
  Na  Na22  1  0.69  0.21  0.97  1.0
  Na  Na23  1  0.05  0.16  0.97  1.0
  Co  Co24  1  0.59  0.41  0.78  1.0
  Co  Co25  1  0.41  0.78  0.59  1.0
  Co  Co26  1  0.59  0.59  0.59  1.0
  Co  Co27  1  0.78  0.59  0.41  1.0
  Co  Co28  1  0.41  0.59  0.96  1.0
  Co  Co29  1  0.59  0.96  0.41  1.0
  Co  Co30  1  0.78  0.78  0.78  1.0
  Co  Co31  1  0.96  0.41  0.59  1.0
  N  N32  1  0.68  0.32  0.68  1.0
  N  N33  1  0.32  0.68  0.68  1.0
  N  N34  1  0.68  0.68  0.68  1.0
  N  N35  1  0.68  0.68  0.32  1.0
  N  N36  1  0.68  0.22  0.37  1.0
  N  N37  1  0.68  0.78  0.0  1.0
  N  N38  1  0.78  0.0  0.68  1.0
  N  N39  1  0.22  0.37  0.68  1.0
  N  N40  1  0.0  0.68  0.78  1.0
  N  N41  1  0.37  0.68  0.22  1.0
  N  N42  1  0.68  0.15  0.0  1.0
  N  N43  1  0.68  0.58  0.37  1.0
  N  N44  1  0.58  0.37  0.68  1.0
  N  N45  1  0.15  0.0  0.68  1.0
  N  N46  1  0.37  0.68  0.58  1.0
  N  N47  1  0.0  0.68  0.15  1.0

data_Na3CoN2
_symmetry_space_group_name_H-M   R3
_cell_length_a   15.19
_cell_length_b   15.19
_cell_length_c   9.3
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   146
_chemical_formula_structural   Na3CoN2
_chemical_formula_sum   'Na72 Co24 N48'
_cell_volume   1857.13
_cell_formula_units_Z   24
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  'x+2/3, y+1/3, z+1/3'
  5  '-y+2/3, x-y+1/3, z+1/3'
  6  '-x+y+2/3, -x+1/3, z+1/3'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
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
  Na  Na0  9  0.01  0.91  0.31  1.0
  Na  Na1  9  0.01  0.75  0.95  1.0
  Na  Na2  9  0.03  0.95  0.29  1.0
  Na  Na3  9  0.04  0.61  0.64  1.0
  Na  Na4  9  0.08  0.03  0.08  1.0
  Na  Na5  9  0.08  0.4  0.08  1.0
  Na  Na6  9  0.1  0.38  0.06  1.0
  Na  Na7  9  0.1  0.01  0.06  1.0
  Co  Co8  9  0.09  0.36  0.32  1.0
  Co  Co9  9  0.15  0.67  0.26  1.0
  Co  Co10  3  0.0  0.0  0.59  1.0
  Co  Co11  3  0.0  0.0  0.78  1.0
  N  N12  9  0.04  0.86  0.55  1.0
  N  N13  9  0.05  0.79  0.95  1.0
  N  N14  9  0.09  0.54  0.23  1.0
  N  N15  9  0.13  0.41  0.09  1.0
  N  N16  9  0.18  0.04  0.82  1.0
  N  N17  3  0.0  0.0  0.68  1.0

Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Na Co Co Co Co Co Co Co Co N N N N N N N N N N N N N N N N