# generated using pymatgen
data_Mn3Mo3C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.00576405
_cell_length_b   8.00588082
_cell_length_c   8.00591588
_cell_angle_alpha   60.00107551
_cell_angle_beta   60.00053900
_cell_angle_gamma   60.00037635
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3Mo3C
_chemical_formula_sum   'Mn12 Mo12 C4'
_cell_volume   362.83942160
_cell_formula_units_Z   4
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  0.12499239  0.12499653  0.62501587  1.0
  Mn  Mn1  1  0.25159621  0.91613255  0.91611724  1.0
  Mn  Mn2  1  0.91614613  0.25159432  0.91611270  1.0
  Mn  Mn3  1  0.33384563  0.33386774  0.33388205  1.0
  Mn  Mn4  1  0.33385529  -0.00160030  0.33389240  1.0
  Mn  Mn5  1  0.33386410  0.33387672  -0.00160201  1.0
  Mn  Mn6  1  -0.00160294  0.33387052  0.33388358  1.0
  Mn  Mn7  1  0.91615457  0.91613649  0.91611934  1.0
  Mn  Mn8  1  0.12499335  0.62501818  0.12499235  1.0
  Mn  Mn9  1  0.62501429  0.12499696  0.12499317  1.0
  Mn  Mn10  1  0.12499274  0.12499685  0.12499284  1.0
  Mn  Mn11  1  0.91614500  0.91611626  0.25159289  1.0
  Mo  Mo12  1  0.56230978  0.56230678  0.93769660  1.0
  Mo  Mo13  1  0.93768994  0.93769123  0.56230804  1.0
  Mo  Mo14  1  0.68769415  0.68769714  0.31230356  1.0
  Mo  Mo15  1  0.31230759  0.68769374  0.68769499  1.0
  Mo  Mo16  1  0.68769560  0.31230257  0.31230543  1.0
  Mo  Mo17  1  0.31230943  0.31230131  0.68769618  1.0
  Mo  Mo18  1  0.56231203  0.93769169  0.56230763  1.0
  Mo  Mo19  1  0.31230802  0.68769582  0.31230269  1.0
  Mo  Mo20  1  0.93768825  0.56230730  0.93769600  1.0
  Mo  Mo21  1  0.93769078  0.56231054  0.56230973  1.0
  Mo  Mo22  1  0.68769393  0.31230225  0.68769730  1.0
  Mo  Mo23  1  0.56230884  0.93768880  0.93769553  1.0
  C  C24  1  0.62500059  0.62500337  0.12499377  1.0
  C  C25  1  0.12499311  0.62500378  0.62500050  1.0
  C  C26  1  0.62500069  0.12499753  0.62499975  1.0
  C  C27  1  0.62500049  0.62500333  0.62499988  1.0