# generated using pymatgen
data_Y3TiMnC6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.20447879
_cell_length_b   8.20447819
_cell_length_c   5.01897151
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998935
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y3TiMnC6
_chemical_formula_sum   'Y6 Ti2 Mn2 C12'
_cell_volume   292.58184196
_cell_formula_units_Z   2
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
  Y  Y0  1  0.62047088  0.67835185  0.75000000  1.0
  Y  Y1  1  0.94212003  0.62047088  0.25000000  1.0
  Y  Y2  1  0.67835185  0.05787997  0.25000000  1.0
  Y  Y3  1  0.32164815  0.94212003  0.75000000  1.0
  Y  Y4  1  0.05787997  0.37952912  0.75000000  1.0
  Y  Y5  1  0.37952912  0.32164815  0.25000000  1.0
  Ti  Ti6  1  0.00000000  0.00000000  0.50000000  1.0
  Ti  Ti7  1  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn8  1  0.66666700  0.33333300  0.75000000  1.0
  Mn  Mn9  1  0.33333300  0.66666700  0.25000000  1.0
  C  C10  1  0.96388899  0.76035868  0.75000000  1.0
  C  C11  1  0.20353031  0.96388899  0.25000000  1.0
  C  C12  1  0.76035868  0.79646969  0.25000000  1.0
  C  C13  1  0.23964132  0.20353031  0.75000000  1.0
  C  C14  1  0.79646969  0.03611101  0.75000000  1.0
  C  C15  1  0.03611101  0.23964132  0.25000000  1.0
  C  C16  1  0.86212960  0.56814834  0.75000000  1.0
  C  C17  1  0.29397926  0.86212960  0.25000000  1.0
  C  C18  1  0.56814834  0.70602074  0.25000000  1.0
  C  C19  1  0.43185166  0.29397926  0.75000000  1.0
  C  C20  1  0.13787040  0.43185166  0.25000000  1.0
  C  C21  1  0.70602074  0.13787040  0.75000000  1.0