data_LaMnCr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07
_cell_length_b   5.07
_cell_length_c   5.07
_cell_angle_alpha   145.28
_cell_angle_beta   120.35
_cell_angle_gamma   70.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMnCr2
_chemical_formula_sum   'La1 Mn1 Cr2'
_cell_volume   62.93
_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
  La  La2  1  0.0  0.52  0.01  1.0
  Mn  Mn3  1  0.0  0.0  0.37  1.0
  Cr  Cr0  1  0.51  0.0  0.01  1.0
  Cr  Cr1  1  0.0  0.0  0.86  1.0

data_LaMnCr2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   5.04
_cell_length_c   5.07
_cell_angle_alpha   119.83
_cell_angle_beta   107.36
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMnCr2
_chemical_formula_sum   'La1 Mn1 Cr2'
_cell_volume   62.93
_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
  La  La0  1  0.48  0.49  0.49  1.0
  Mn  Mn1  1  0.0  0.37  0.37  1.0
  Cr  Cr2  1  0.0  0.01  0.5  1.0
  Cr  Cr3  1  0.0  0.86  0.86  1.0

La Mn Cr Cr