# generated using pymatgen
data_TmMnO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.05319657
_cell_length_b   6.05319657
_cell_length_c   11.35090639
_cell_angle_alpha   90.00000040
_cell_angle_beta   90.00000095
_cell_angle_gamma   119.99987198
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmMnO3
_chemical_formula_sum   'Tm6 Mn6 O18'
_cell_volume   360.18969891
_cell_formula_units_Z   6
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
  Tm  Tm0  1  0.66666635  0.33333306  0.72781865  1.0
  Tm  Tm1  1  0.00000015  0.00000016  0.77291275  1.0
  Tm  Tm2  1  0.33333352  0.66666690  0.22780691  1.0
  Tm  Tm3  1  0.66666685  0.33333372  0.22780686  1.0
  Tm  Tm4  1  -0.00000009  -0.00000013  0.27291290  1.0
  Tm  Tm5  1  0.33333308  0.66666630  0.72781871  1.0
  Mn  Mn6  1  0.66650240  0.66650242  0.99725026  1.0
  Mn  Mn7  1  -0.00000350  0.33349050  0.99725019  1.0
  Mn  Mn8  1  0.00000346  0.66650566  0.49724766  1.0
  Mn  Mn9  1  0.33349072  -0.00000348  0.99725020  1.0
  Mn  Mn10  1  0.66650550  0.00000339  0.49724761  1.0
  Mn  Mn11  1  0.33350141  0.33350139  0.49724770  1.0
  O  O12  1  0.66666623  0.33333267  0.51788792  1.0
  O  O13  1  0.63917846  0.63917842  0.83273929  1.0
  O  O14  1  0.36082097  -0.00000019  0.83273934  1.0
  O  O15  1  0.69453732  0.00000013  0.66201205  1.0
  O  O16  1  -0.00000031  0.36082067  0.83273934  1.0
  O  O17  1  0.33333252  0.66666612  0.51788785  1.0
  O  O18  1  -0.00000018  0.30545862  0.16201194  1.0
  O  O19  1  0.36081287  0.36081286  0.33273665  1.0
  O  O20  1  0.00000024  0.63918773  0.33273680  1.0
  O  O21  1  0.30546321  0.30546316  0.66201205  1.0
  O  O22  1  0.69454065  0.69454075  0.16201190  1.0
  O  O23  1  0.00000013  0.00000006  0.97269344  1.0
  O  O24  1  0.30545868  -0.00000018  0.16201195  1.0
  O  O25  1  0.33333350  0.66666708  0.01788297  1.0
  O  O26  1  0.00000019  0.69453728  0.66201198  1.0
  O  O27  1  0.63918771  0.00000037  0.33273670  1.0
  O  O28  1  -0.00000020  -0.00000019  0.47269137  1.0
  O  O29  1  0.66666716  0.33333375  0.01788305  1.0