# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.37106583
_cell_length_b   13.54315778
_cell_length_c   50.81342750
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   63.94628354
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm120
_cell_volume   9503.06663344
_cell_formula_units_Z   120
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  0.682817  0.210204  0.268054  1
  Sm  Sm2  1  0.061260  0.269208  0.258310  1
  Sm  Sm3  1  0.311115  0.157004  0.287200  1
  Sm  Sm4  1  0.682817  0.710204  0.268054  1
  Sm  Sm5  1  0.061260  0.769208  0.258310  1
  Sm  Sm6  1  0.311115  0.657004  0.287200  1
  Sm  Sm7  1  0.792046  0.415775  0.284238  1
  Sm  Sm8  1  0.169293  0.462790  0.270576  1
  Sm  Sm9  1  0.544388  0.526537  0.258265  1
  Sm  Sm10  1  0.792046  0.915775  0.284238  1
  Sm  Sm11  1  0.169293  0.962790  0.270576  1
  Sm  Sm12  1  0.544388  0.026537  0.258265  1
  Sm  Sm13  1  0.557424  0.116127  0.321636  1
  Sm  Sm14  1  0.929152  0.124260  0.296617  1
  Sm  Sm15  1  0.164332  0.087653  0.332770  1
  Sm  Sm16  1  0.557424  0.616127  0.321636  1
  Sm  Sm17  1  0.929152  0.624260  0.296617  1
  Sm  Sm18  1  0.164332  0.587653  0.332770  1
  Sm  Sm19  1  0.622120  0.348324  0.327612  1
  Sm  Sm20  1  1.014765  0.362303  0.318689  1
  Sm  Sm21  1  0.412973  0.366122  0.294265  1
  Sm  Sm22  1  0.622120  0.848324  0.327612  1
  Sm  Sm23  1  1.014765  0.862303  0.318689  1
  Sm  Sm24  1  0.412973  0.866122  0.294265  1
  Sm  Sm25  1  0.390262  0.037590  0.359578  1
  Sm  Sm26  1  0.781527  0.063879  0.346936  1
  Sm  Sm27  1  0.998298  0.024137  0.375573  1
  Sm  Sm28  1  0.390262  0.537590  0.359578  1
  Sm  Sm29  1  0.781527  0.563879  0.346936  1
  Sm  Sm30  1  0.998298  0.524137  0.375573  1
  Sm  Sm31  1  0.445280  0.280060  0.371682  1
  Sm  Sm32  1  0.840111  0.298120  0.355907  1
  Sm  Sm33  1  0.234895  0.319688  0.342084  1
  Sm  Sm34  1  0.445280  0.780060  0.371682  1
  Sm  Sm35  1  0.840111  0.798120  0.355907  1
  Sm  Sm36  1  0.234895  0.819688  0.342084  1
  Sm  Sm37  1  0.218566  0.970643  0.404049  1
  Sm  Sm38  1  0.608244  0.993878  0.390358  1
  Sm  Sm39  1  0.827989  0.948135  0.418572  1
  Sm  Sm40  1  0.218566  0.470643  0.404049  1
  Sm  Sm41  1  0.608244  0.493878  0.390358  1
  Sm  Sm42  1  0.827989  0.448135  0.418572  1
  Sm  Sm43  1  0.277987  0.202433  0.412669  1
  Sm  Sm44  1  0.665607  0.228374  0.397568  1
  Sm  Sm45  1  0.056433  0.258922  0.386554  1
  Sm  Sm46  1  0.277987  0.702433  0.412669  1
  Sm  Sm47  1  0.665607  0.728374  0.397568  1
  Sm  Sm48  1  0.056433  0.758922  0.386554  1
  Sm  Sm49  1  0.047876  0.900557  0.446931  1
  Sm  Sm50  1  0.439214  0.922362  0.432659  1
  Sm  Sm51  1  0.658169  0.873637  0.460851  1
  Sm  Sm52  1  0.047876  0.400557  0.446931  1
  Sm  Sm53  1  0.439214  0.422362  0.432659  1
  Sm  Sm54  1  0.658169  0.373637  0.460851  1
  Sm  Sm55  1  0.103685  0.134590  0.455233  1
  Sm  Sm56  1  0.494459  0.158534  0.441412  1
  Sm  Sm57  1  0.883758  0.182704  0.426670  1
  Sm  Sm58  1  0.103685  0.634590  0.455233  1
  Sm  Sm59  1  0.494459  0.658534  0.441412  1
  Sm  Sm60  1  0.883758  0.682704  0.426670  1
  Sm  Sm61  1  0.876339  0.825751  0.488717  1
  Sm  Sm62  1  0.267112  0.849695  0.474896  1
  Sm  Sm63  1  0.487039  0.801581  0.503458  1
  Sm  Sm64  1  0.876339  0.325751  0.488717  1
  Sm  Sm65  1  0.267112  0.349695  0.474896  1
  Sm  Sm66  1  0.487039  0.301581  0.503458  1
  Sm  Sm67  1  0.931584  0.061923  0.497469  1
  Sm  Sm68  1  0.322921  0.083727  0.483197  1
  Sm  Sm69  1  0.712629  0.110648  0.469277  1
  Sm  Sm70  1  0.931584  0.561923  0.497469  1
  Sm  Sm71  1  0.322921  0.583727  0.483197  1
  Sm  Sm72  1  0.712629  0.610648  0.469277  1
  Sm  Sm73  1  0.705190  0.755910  0.532561  1
  Sm  Sm74  1  0.092811  0.781851  0.517459  1
  Sm  Sm75  1  0.314365  0.725362  0.543574  1
  Sm  Sm76  1  0.705190  0.255910  0.532561  1
  Sm  Sm77  1  0.092811  0.281851  0.517459  1
  Sm  Sm78  1  0.314365  0.225362  0.543574  1
  Sm  Sm79  1  0.762553  0.990406  0.539771  1
  Sm  Sm80  1  0.152231  0.013642  0.526079  1
  Sm  Sm81  1  0.542809  0.036150  0.511556  1
  Sm  Sm82  1  0.762553  0.490406  0.539771  1
  Sm  Sm83  1  0.152231  0.513642  0.526079  1
  Sm  Sm84  1  0.542809  0.536150  0.511556  1
  Sm  Sm85  1  0.530686  0.686164  0.574221  1
  Sm  Sm86  1  0.925517  0.704224  0.558446  1
  Sm  Sm87  1  0.135903  0.664596  0.588044  1
  Sm  Sm88  1  0.530686  0.186164  0.574221  1
  Sm  Sm89  1  0.925517  0.204224  0.558446  1
  Sm  Sm90  1  0.135903  0.164596  0.588044  1
  Sm  Sm91  1  0.589271  0.920406  0.583193  1
  Sm  Sm92  1  0.980536  0.946695  0.570551  1
  Sm  Sm93  1  0.372500  0.960148  0.554555  1
  Sm  Sm94  1  0.589271  0.420406  0.583193  1
  Sm  Sm95  1  0.980536  0.446695  0.570551  1
  Sm  Sm96  1  0.372500  0.460148  0.554555  1
  Sm  Sm97  1  0.356033  0.621982  0.611439  1
  Sm  Sm98  1  0.748678  0.635961  0.602517  1
  Sm  Sm99  1  0.957825  0.618163  0.635863  1
  Sm  Sm100  1  0.356033  0.121982  0.611439  1
  Sm  Sm101  1  0.748678  0.135961  0.602517  1
  Sm  Sm102  1  0.957825  0.118163  0.635863  1
  Sm  Sm103  1  0.441645  0.860025  0.633511  1
  Sm  Sm104  1  0.813374  0.868157  0.608493  1
  Sm  Sm105  1  0.206466  0.896631  0.597358  1
  Sm  Sm106  1  0.441645  0.360025  0.633511  1
  Sm  Sm107  1  0.813374  0.368157  0.608493  1
  Sm  Sm108  1  0.206466  0.396631  0.597358  1
  Sm  Sm109  1  0.201505  0.521495  0.659553  1
  Sm  Sm110  1  0.578752  0.568510  0.645890  1
  Sm  Sm111  1  0.826409  0.457747  0.671863  1
  Sm  Sm112  1  0.201505  0.021495  0.659553  1
  Sm  Sm113  1  0.578752  0.068510  0.645890  1
  Sm  Sm114  1  0.826409  0.957747  0.671863  1
  Sm  Sm115  1  0.309537  0.715077  0.671819  1
  Sm  Sm116  1  0.687980  0.774081  0.662074  1
  Sm  Sm117  1  0.059682  0.827281  0.642928  1
  Sm  Sm118  1  0.309537  0.215077  0.671819  1
  Sm  Sm119  1  0.687980  0.274081  0.662074  1
  Sm  Sm120  1  0.059682  0.327281  0.642928  1
