data_Ag3SnP7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.1
_cell_length_b   6.01
_cell_length_c   26.11
_cell_angle_alpha   90.0
_cell_angle_beta   96.02
_cell_angle_gamma   98.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag3SnP7
_chemical_formula_sum   'Ag3 Sn1 P7'
_cell_volume   787.12
_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
  Ag  Ag0  1  0.7  0.37  0.04  1.0
  Ag  Ag1  1  0.56  0.39  0.22  1.0
  Ag  Ag2  1  0.0  0.35  0.16  1.0
  Sn  Sn3  1  0.5  0.01  0.12  1.0
  P  P4  1  0.21  0.29  0.06  1.0
  P  P5  1  0.01  0.99  0.2  1.0
  P  P6  1  0.06  0.75  0.14  1.0
  P  P7  1  0.95  0.04  0.01  1.0
  P  P8  1  0.77  0.78  0.07  1.0
  P  P9  1  0.38  0.01  0.26  1.0
  P  P10  1  0.62  0.8  0.21  1.0

Ag Ag Ag Sn P P P P P P P 0 4 o o o 0 4 + o o 0 8 o o o 0 7 o o o 0 3 o o o 1 9 o o o 1 10 o o o 2 6 o o o 2 4 o o o 2 5 o - o 2 3 - o o 3 6 o - o 3 4 o o o 3 8 o - o 3 5 + - o 3 10 o - o 4 7 - o o 5 10 - o o 5 6 o o o 5 9 o + o 6 8 - o o 7 8 o - o 9 10 o - o 
data_Ag3SnP7
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.1
_cell_length_b   6.01
_cell_length_c   26.08
_cell_angle_alpha   88.25
_cell_angle_beta   84.79
_cell_angle_gamma   81.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag3SnP7
_chemical_formula_sum   'Ag3 Sn1 P7'
_cell_volume   787.12
_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
  Ag  Ag0  1  0.15  0.35  0.84  1.0
  Ag  Ag1  1  0.34  0.37  0.96  1.0
  Ag  Ag2  1  0.67  0.39  0.78  1.0
  Sn  Sn3  1  0.62  0.01  0.88  1.0
  P  P4  1  0.07  0.04  0.99  1.0
  P  P5  1  0.07  0.75  0.86  1.0
  P  P6  1  0.19  0.99  0.8  1.0
  P  P7  1  0.3  0.78  0.93  1.0
  P  P8  1  0.6  0.8  0.79  1.0
  P  P9  1  0.86  0.29  0.94  1.0
  P  P10  1  0.87  0.01  0.74  1.0
