data_BaMgV2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.25
_cell_length_b   6.25
_cell_length_c   6.25
_cell_angle_alpha   150.99
_cell_angle_beta   126.9
_cell_angle_gamma   61.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMgV2
_chemical_formula_sum   'Ba1 Mg1 V2'
_cell_volume   93.98
_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
  Ba  Ba0  1  0.57  0.0  0.08  1.0
  Mg  Mg1  1  0.0  0.0  0.33  1.0
  V  V2  1  0.57  0.0  0.53  1.0
  V  V3  1  0.0  0.0  0.16  1.0

data_BaMgV2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.13
_cell_length_b   5.59
_cell_length_c   6.25
_cell_angle_alpha   116.55
_cell_angle_beta   104.51
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMgV2
_chemical_formula_sum   'Ba1 Mg1 V2'
_cell_volume   93.98
_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
  Ba  Ba0  1  0.48  0.92  0.48  1.0
  Mg  Mg1  1  0.67  0.67  0.67  1.0
  V  V2  1  0.03  0.47  0.03  1.0
  V  V3  1  0.84  0.84  0.84  1.0

Ba Mg V V
Ba Mg V V 0 3 + o o 0 1 + o o 0 2 o o o 0 2 o o - 1 3 o o o 1 2 o o o 2 3 o o o 2 3 + o + 2 2 o + + 