data_Ca2MnTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.24
_cell_length_b   6.13
_cell_length_c   6.13
_cell_angle_alpha   41.21
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2MnTe
_chemical_formula_sum   'Ca2 Mn1 Te1'
_cell_volume   104.98
_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
  Ca  Ca0  1  0.0  0.0  0.16  1.0
  Ca  Ca1  1  0.12  0.0  0.54  1.0
  Mn  Mn2  1  0.0  0.0  0.36  1.0
  Te  Te3  1  0.12  0.0  0.93  1.0

data_Ca2MnTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.24
_cell_length_b   4.31
_cell_length_c   6.13
_cell_angle_alpha   110.61
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2MnTe
_chemical_formula_sum   'Ca2 Mn1 Te1'
_cell_volume   104.98
_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
  Ca  Ca0  1  0.0  0.16  0.16  1.0
  Ca  Ca1  1  0.88  0.54  0.54  1.0
  Mn  Mn2  1  0.0  0.36  0.36  1.0
  Te  Te3  1  0.88  0.93  0.93  1.0

Ca Ca Mn Te