data_Mn2VAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.72
_cell_length_b   4.72
_cell_length_c   3.86
_cell_angle_alpha   112.38
_cell_angle_beta   112.38
_cell_angle_gamma   37.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VAs
_chemical_formula_sum   'Mn2 V1 As1'
_cell_volume   48.19
_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
  Mn  Mn1  1  0.01  0.0  0.07  1.0
  Mn  Mn2  1  0.08  0.0  0.59  1.0
  V  V3  1  0.7  0.0  0.81  1.0
  As  As0  1  0.3  0.0  0.82  1.0

data_Mn2VAs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.05
_cell_length_b   3.86
_cell_length_c   4.72
_cell_angle_alpha   112.38
_cell_angle_beta   108.84
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VAs
_chemical_formula_sum   'Mn2 V1 As1'
_cell_volume   48.19
_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
  Mn  Mn0  1  0.0  0.07  0.01  1.0
  Mn  Mn1  1  0.0  0.59  0.08  1.0
  V  V2  1  0.0  0.81  0.7  1.0
  As  As3  1  0.0  0.82  0.3  1.0

Mn Mn V As