data_SrZr7N10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.65
_cell_length_b   6.9
_cell_length_c   13.72
_cell_angle_alpha   90.0
_cell_angle_beta   91.97
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrZr7N10
_chemical_formula_sum   'Sr2 Zr14 N20'
_cell_volume   629.35
_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
  Sr  Sr0  1  0.51  0.52  0.46  1.0
  Sr  Sr1  1  0.74  0.38  0.61  1.0
  Zr  Zr2  1  0.31  0.57  0.36  1.0
  Zr  Zr3  1  0.55  0.33  0.5  1.0
  Zr  Zr4  1  0.96  0.27  0.53  1.0
  Zr  Zr5  1  0.72  0.63  0.39  1.0
  Zr  Zr6  1  0.8  0.03  0.08  1.0
  Zr  Zr7  1  0.57  0.87  0.94  1.0
  Zr  Zr8  1  0.57  0.07  0.53  1.0
  Zr  Zr9  1  0.81  0.83  0.67  1.0
  Zr  Zr10  1  0.41  0.75  0.79  1.0
  Zr  Zr11  1  0.65  0.15  0.94  1.0
  Zr  Zr12  1  0.18  0.78  0.06  1.0
  Zr  Zr13  1  0.42  0.12  0.21  1.0
  Zr  Zr14  1  0.0  0.02  0.38  1.0
  Zr  Zr15  1  0.24  0.88  0.53  1.0
  N  N16  1  0.77  0.79  0.73  1.0
  N  N17  1  0.01  0.11  0.88  1.0
  N  N18  1  0.86  0.1  0.52  1.0
  N  N19  1  0.09  0.81  0.66  1.0
  N  N20  1  0.79  0.82  0.19  1.0
  N  N21  1  0.02  0.08  0.33  1.0
  N  N22  1  0.52  0.98  0.88  1.0
  N  N23  1  0.28  0.93  0.73  1.0
  N  N24  1  0.92  0.21  0.03  1.0
  N  N25  1  0.16  0.69  0.17  1.0
  N  N26  1  0.93  0.02  0.33  1.0
  N  N27  1  0.16  0.88  0.47  1.0
  N  N28  1  0.22  0.61  0.83  1.0
  N  N29  1  0.99  0.29  0.69  1.0
  N  N30  1  0.19  0.29  0.81  1.0
  N  N31  1  0.43  0.61  0.95  1.0
  N  N32  1  0.24  0.85  0.44  1.0
  N  N33  1  0.47  0.05  0.58  1.0
  N  N34  1  0.89  0.08  0.43  1.0
  N  N35  1  0.66  0.82  0.29  1.0

data_SrZr7N10
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.65
_cell_length_b   6.9
_cell_length_c   13.72
_cell_angle_alpha   90.0
_cell_angle_beta   91.97
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrZr7N10
_chemical_formula_sum   'Sr2 Zr14 N20'
_cell_volume   629.35
_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
  Sr  Sr0  1  0.51  0.52  0.46  1.0
  Sr  Sr1  1  0.74  0.38  0.61  1.0
  Zr  Zr2  1  0.0  0.02  0.38  1.0
  Zr  Zr3  1  0.18  0.78  0.06  1.0
  Zr  Zr4  1  0.24  0.88  0.53  1.0
  Zr  Zr5  1  0.31  0.57  0.36  1.0
  Zr  Zr6  1  0.41  0.75  0.79  1.0
  Zr  Zr7  1  0.42  0.12  0.21  1.0
  Zr  Zr8  1  0.55  0.33  0.5  1.0
  Zr  Zr9  1  0.57  0.87  0.94  1.0
  Zr  Zr10  1  0.57  0.07  0.53  1.0
  Zr  Zr11  1  0.65  0.15  0.94  1.0
  Zr  Zr12  1  0.72  0.63  0.39  1.0
  Zr  Zr13  1  0.8  0.03  0.08  1.0
  Zr  Zr14  1  0.81  0.83  0.67  1.0
  Zr  Zr15  1  0.96  0.27  0.53  1.0
  N  N16  1  0.01  0.11  0.88  1.0
  N  N17  1  0.02  0.08  0.33  1.0
  N  N18  1  0.09  0.81  0.66  1.0
  N  N19  1  0.16  0.69  0.17  1.0
  N  N20  1  0.16  0.88  0.47  1.0
  N  N21  1  0.19  0.29  0.81  1.0
  N  N22  1  0.22  0.61  0.83  1.0
  N  N23  1  0.24  0.85  0.44  1.0
  N  N24  1  0.28  0.93  0.73  1.0
  N  N25  1  0.43  0.61  0.95  1.0
  N  N26  1  0.47  0.05  0.58  1.0
  N  N27  1  0.52  0.98  0.88  1.0
  N  N28  1  0.66  0.82  0.29  1.0
  N  N29  1  0.77  0.79  0.73  1.0
  N  N30  1  0.79  0.82  0.19  1.0
  N  N31  1  0.86  0.1  0.52  1.0
  N  N32  1  0.89  0.08  0.43  1.0
  N  N33  1  0.92  0.21  0.03  1.0
  N  N34  1  0.93  0.02  0.33  1.0
  N  N35  1  0.99  0.29  0.69  1.0

Sr Sr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr N N N N N N N N N N N N N N N N N N N N
Sr Sr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr N N N N N N N N N N N N N N N N N N N N 0 3 o o o 0 2 o o o 0 5 o o o 1 3 o o o 1 4 o o o 1 29 o o o 2 32 o o o 4 18 o o o 4 29 o o o 5 35 o o o 6 20 o - o 6 24 o o o 6 13 o o o 7 22 o o o 7 11 o + o 7 31 o o o 8 33 o o o 9 16 o o o 9 19 + o o 10 28 o o o 10 23 o o o 10 22 o o o 10 31 o o o 11 22 o - o 12 25 o o o 12 13 o + o 12 31 o o - 13 25 o - o 13 21 o o o 13 14 o o o 13 26 - o o 13 26 o o o 13 20 o - o 13 35 o - o 14 26 - o o 14 21 o o o 14 34 - o o 15 27 o o o 17 24 - o + 17 30 o o o 18 34 o o o 19 23 o o o 20 35 o o o 21 26 - o o 27 32 o o o 28 30 o o o 28 31 o o o 29 30 + o o 