data_ScVAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11
_cell_length_b   3.33
_cell_length_c   6.6
_cell_angle_alpha   90.0
_cell_angle_beta   99.48
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScVAs2
_chemical_formula_sum   'Sc1 V1 As2'
_cell_volume   67.43
_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
  Sc  Sc2  1  0.0  0.0  0.0  1.0
  V  V3  1  0.46  0.0  0.25  1.0
  As  As0  1  0.88  0.66  0.67  1.0
  As  As1  1  0.15  0.66  0.84  1.0

data_ScVAs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.11
_cell_length_b   3.33
_cell_length_c   6.6
_cell_angle_alpha   90.0
_cell_angle_beta   99.48
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScVAs2
_chemical_formula_sum   'Sc1 V1 As2'
_cell_volume   67.43
_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
  Sc  Sc0  1  0.0  0.0  0.0  1.0
  V  V1  1  0.46  0.0  0.25  1.0
  As  As2  1  0.15  0.66  0.84  1.0
  As  As3  1  0.88  0.66  0.67  1.0

Sc V As As