data_ZnAs2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.93
_cell_length_b   9.93
_cell_length_c   9.93
_cell_angle_alpha   16.68
_cell_angle_beta   16.68
_cell_angle_gamma   16.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnAs2P
_chemical_formula_sum   'Zn1 As2 P1'
_cell_volume   70.26
_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
  Zn  Zn3  1  0.0  0.0  0.68  1.0
  As  As0  1  0.0  0.0  0.3  1.0
  As  As1  1  0.0  0.0  0.06  1.0
  P  P2  1  0.0  0.0  0.0  1.0

data_ZnAs2P
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.99
_cell_length_b   2.88
_cell_length_c   9.93
_cell_angle_alpha   90.0
_cell_angle_beta   99.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ZnAs2P
_chemical_formula_sum   'Zn2 As4 P2'
_cell_volume   140.53
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Zn  Zn0  2  0.0  0.0  0.32  1.0
  As  As1  2  0.0  0.0  0.7  1.0
  As  As2  2  0.0  0.0  0.94  1.0
  P  P3  2  0.0  0.0  0.0  1.0

Zn As As P
Zn As As P 0 0 o + - 0 0 + - o 0 0 + o - 0 3 o o + 1 1 o + - 1 1 + - o 1 1 + o - 1 3 o o o 1 2 o o o 2 3 o o o 