# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.83908079
_cell_length_b   10.04083813
_cell_length_c   62.62739778
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   80.58490744
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm30
_cell_volume   2381.61461088
_cell_formula_units_Z   30
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
  Sm  Sm1  1  0.312648  0.539465  0.270930  1
  Sm  Sm2  1  0.874839  1.056817  0.211022  1
  Sm  Sm3  1  0.532555  0.774908  0.235789  1
  Sm  Sm4  1  0.943406  0.415918  0.223796  1
  Sm  Sm5  1  0.401631  0.166050  0.256975  1
  Sm  Sm6  1  -0.031700  0.906374  0.282845  1
  Sm  Sm7  1  0.030178  0.788599  0.360714  1
  Sm  Sm8  1  0.918191  0.290660  0.300895  1
  Sm  Sm9  1  0.446720  1.036611  0.329774  1
  Sm  Sm10  1  0.654473  0.665430  0.315545  1
  Sm  Sm11  1  0.353686  0.417780  0.345628  1
  Sm  Sm12  1  -0.038761  0.165624  0.375494  1
  Sm  Sm13  1  0.004430  1.043413  0.451068  1
  Sm  Sm14  1  0.716234  0.540625  0.390778  1
  Sm  Sm15  1  0.407360  0.293743  0.421032  1
  Sm  Sm16  1  0.488459  0.916496  0.405854  1
  Sm  Sm17  1  0.085530  0.666167  0.435890  1
  Sm  Sm18  1  0.776656  0.419285  0.466144  1
  Sm  Sm19  1  0.838416  0.294479  0.541377  1
  Sm  Sm20  1  0.531650  0.794285  0.481428  1
  Sm  Sm21  1  0.139204  0.542130  0.511294  1
  Sm  Sm22  1  0.462711  0.171310  0.496208  1
  Sm  Sm23  1  0.046169  0.923299  0.527148  1
  Sm  Sm24  1  0.574698  0.669250  0.556027  1
  Sm  Sm25  1  0.549483  0.543991  0.633126  1
  Sm  Sm26  1  0.524589  1.053535  0.574077  1
  Sm  Sm27  1  0.091258  0.793860  0.599947  1
  Sm  Sm28  1  0.180241  0.420444  0.585992  1
  Sm  Sm29  1  -0.039665  0.185001  0.621133  1
  Sm  Sm30  1  0.618050  0.903092  0.645900  1
