data_YVAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.79
_cell_length_b   5.79
_cell_length_c   5.79
_cell_angle_alpha   139.86
_cell_angle_beta   139.86
_cell_angle_gamma   58.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YVAs2
_chemical_formula_sum   'Y1 V1 As2'
_cell_volume   79.83
_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
  Y  Y3  1  0.99  0.0  0.53  1.0
  V  V2  1  0.0  0.0  0.0  1.0
  As  As0  1  0.0  0.0  0.06  1.0
  As  As1  1  0.0  0.99  0.53  1.0

data_YVAs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.97
_cell_length_b   3.97
_cell_length_c   5.79
_cell_angle_alpha   110.07
_cell_angle_beta   110.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YVAs2
_chemical_formula_sum   'Y1 V1 As2'
_cell_volume   79.83
_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
  Y  Y0  1  0.47  0.0  0.46  1.0
  V  V1  1  0.0  0.0  0.0  1.0
  As  As2  1  0.46  0.99  0.46  1.0
  As  As3  1  0.94  0.0  0.94  1.0

Y V As As