# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.33189181
_cell_length_b   18.51186399
_cell_length_c   49.48419995
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.76573874
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm144
_cell_volume   10599.4131408
_cell_formula_units_Z   144
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  0.928417  0.597511  0.262842  1
  Sm  Sm2  1  0.428417  0.597511  0.262842  1
  Sm  Sm3  1  0.059612  0.931226  0.257541  1
  Sm  Sm4  1  0.857764  0.256683  0.271362  1
  Sm  Sm5  1  0.559612  0.931226  0.257541  1
  Sm  Sm6  1  0.357764  0.256683  0.271362  1
  Sm  Sm7  1  0.088468  0.732702  0.271627  1
  Sm  Sm8  1  0.588468  0.732702  0.271627  1
  Sm  Sm9  1  0.176035  0.097226  0.260533  1
  Sm  Sm10  1  0.224527  0.473477  0.248983  1
  Sm  Sm11  1  0.676035  0.097226  0.260533  1
  Sm  Sm12  1  0.724527  0.473477  0.248983  1
  Sm  Sm13  1  0.714714  0.564062  0.309855  1
  Sm  Sm14  1  0.214714  0.564062  0.309855  1
  Sm  Sm15  1  0.813209  0.903741  0.293482  1
  Sm  Sm16  1  0.626180  0.223411  0.318560  1
  Sm  Sm17  1  0.313209  0.903741  0.293482  1
  Sm  Sm18  1  0.126180  0.223411  0.318560  1
  Sm  Sm19  1  0.827258  0.729200  0.313891  1
  Sm  Sm20  1  0.327258  0.729200  0.313891  1
  Sm  Sm21  1  0.919190  0.075448  0.302136  1
  Sm  Sm22  1  1.006635  0.404088  0.285315  1
  Sm  Sm23  1  0.419190  0.075448  0.302136  1
  Sm  Sm24  1  0.506635  0.404088  0.285315  1
  Sm  Sm25  1  0.469756  0.538112  0.344690  1
  Sm  Sm26  1  0.969756  0.538112  0.344690  1
  Sm  Sm27  1  0.553531  0.878666  0.332141  1
  Sm  Sm28  1  0.382261  0.197823  0.358469  1
  Sm  Sm29  1  0.053531  0.878666  0.332141  1
  Sm  Sm30  1  0.882261  0.197823  0.358469  1
  Sm  Sm31  1  0.569422  0.705967  0.352142  1
  Sm  Sm32  1  0.069422  0.705967  0.352142  1
  Sm  Sm33  1  0.666091  0.039934  0.338264  1
  Sm  Sm34  1  0.753344  0.378545  0.325629  1
  Sm  Sm35  1  0.166091  0.039934  0.338264  1
  Sm  Sm36  1  0.253344  0.378545  0.325629  1
  Sm  Sm37  1  0.211045  0.514710  0.383868  1
  Sm  Sm38  1  0.711045  0.514710  0.383868  1
  Sm  Sm39  1  0.297146  0.856460  0.371564  1
  Sm  Sm40  1  0.127396  0.173464  0.396196  1
  Sm  Sm41  1  0.797146  0.856460  0.371564  1
  Sm  Sm42  1  0.627396  0.173464  0.396196  1
  Sm  Sm43  1  0.315787  0.676872  0.388211  1
  Sm  Sm44  1  0.815787  0.676872  0.388211  1
  Sm  Sm45  1  0.405361  0.018594  0.375934  1
  Sm  Sm46  1  0.489059  0.363721  0.363873  1
  Sm  Sm47  1  0.905361  0.018594  0.375934  1
  Sm  Sm48  1  0.989059  0.363721  0.363873  1
  Sm  Sm49  1  0.956411  0.490774  0.421915  1
  Sm  Sm50  1  0.456411  0.490774  0.421915  1
  Sm  Sm51  1  0.042420  0.832639  0.409815  1
  Sm  Sm52  1  0.871102  0.148829  0.434412  1
  Sm  Sm53  1  0.542420  0.832639  0.409815  1
  Sm  Sm54  1  0.371102  0.148829  0.434412  1
  Sm  Sm55  1  0.059175  0.654376  0.426680  1
  Sm  Sm56  1  0.559175  0.654376  0.426680  1
  Sm  Sm57  1  0.146316  0.996161  0.413924  1
  Sm  Sm58  1  0.231518  0.336677  0.401225  1
  Sm  Sm59  1  0.646316  0.996161  0.413924  1
  Sm  Sm60  1  0.731518  0.336677  0.401225  1
  Sm  Sm61  1  0.700372  0.465614  0.460044  1
  Sm  Sm62  1  0.200372  0.465614  0.460044  1
  Sm  Sm63  1  0.786447  0.807153  0.447286  1
  Sm  Sm64  1  0.614712  0.124671  0.472547  1
  Sm  Sm65  1  0.286447  0.807153  0.447286  1
  Sm  Sm66  1  0.114712  0.124671  0.472547  1
  Sm  Sm67  1  0.803329  0.629306  0.464387  1
  Sm  Sm68  1  0.303329  0.629306  0.464387  1
  Sm  Sm69  1  0.888894  0.971310  0.451972  1
  Sm  Sm70  1  0.974603  0.312266  0.439013  1
  Sm  Sm71  1  0.388894  0.971310  0.451972  1
  Sm  Sm72  1  0.474603  0.312266  0.439013  1
  Sm  Sm73  1  0.444331  0.440824  0.497751  1
  Sm  Sm74  1  0.944331  0.440824  0.497751  1
  Sm  Sm75  1  0.529896  0.782828  0.485336  1
  Sm  Sm76  1  0.358623  0.099868  0.510709  1
  Sm  Sm77  1  0.029896  0.782828  0.485336  1
  Sm  Sm78  1  0.858623  0.099868  0.510709  1
  Sm  Sm79  1  0.546779  0.604981  0.502437  1
  Sm  Sm80  1  0.046779  0.604981  0.502437  1
  Sm  Sm81  1  0.632854  0.946521  0.489679  1
  Sm  Sm82  1  0.718514  0.287463  0.477176  1
  Sm  Sm83  1  0.132854  0.946521  0.489679  1
  Sm  Sm84  1  0.218514  0.287463  0.477176  1
  Sm  Sm85  1  0.186910  0.415974  0.535798  1
  Sm  Sm86  1  0.686910  0.415974  0.535798  1
  Sm  Sm87  1  0.274051  0.757758  0.523043  1
  Sm  Sm88  1  0.101708  0.075457  0.548498  1
  Sm  Sm89  1  0.774051  0.757758  0.523043  1
  Sm  Sm90  1  0.601708  0.075457  0.548498  1
  Sm  Sm91  1  0.290806  0.579495  0.539907  1
  Sm  Sm92  1  0.790806  0.579495  0.539907  1
  Sm  Sm93  1  0.376815  0.921361  0.527808  1
  Sm  Sm94  1  0.462123  0.263306  0.515311  1
  Sm  Sm95  1  0.876815  0.921361  0.527808  1
  Sm  Sm96  1  0.962123  0.263306  0.515311  1
  Sm  Sm97  1  0.927865  0.393541  0.573789  1
  Sm  Sm98  1  0.427865  0.393541  0.573789  1
  Sm  Sm99  1  1.017439  0.735263  0.561512  1
  Sm  Sm100  1  0.844167  0.048414  0.585849  1
  Sm  Sm101  1  0.517439  0.735263  0.561512  1
  Sm  Sm102  1  0.344167  0.048414  0.585849  1
  Sm  Sm103  1  0.036080  0.555675  0.578159  1
  Sm  Sm104  1  0.536080  0.555675  0.578159  1
  Sm  Sm105  1  0.122181  0.897425  0.565854  1
  Sm  Sm106  1  0.205829  0.238670  0.553527  1
  Sm  Sm107  1  0.622181  0.897425  0.565854  1
  Sm  Sm108  1  0.705829  0.238670  0.553527  1
  Sm  Sm109  1  0.667135  0.372200  0.611459  1
  Sm  Sm110  1  0.167135  0.372200  0.611459  1
  Sm  Sm111  1  0.763804  0.706167  0.597580  1
  Sm  Sm112  1  0.579882  0.033589  0.624094  1
  Sm  Sm113  1  0.263804  0.706167  0.597580  1
  Sm  Sm114  1  0.079882  0.033589  0.624094  1
  Sm  Sm115  1  0.779695  0.533468  0.617581  1
  Sm  Sm116  1  0.279695  0.533468  0.617581  1
  Sm  Sm117  1  0.863470  0.874022  0.605033  1
  Sm  Sm118  1  0.950965  0.214312  0.591254  1
  Sm  Sm119  1  0.363470  0.874022  0.605033  1
  Sm  Sm120  1  0.450965  0.214312  0.591254  1
  Sm  Sm121  1  0.414035  0.336687  0.647587  1
  Sm  Sm122  1  0.914035  0.336687  0.647587  1
  Sm  Sm123  1  0.505967  0.682935  0.635832  1
  Sm  Sm124  1  0.326591  0.008047  0.664407  1
  Sm  Sm125  1  1.005967  0.682935  0.635832  1
  Sm  Sm126  1  0.826591  0.008047  0.664407  1
  Sm  Sm127  1  0.520017  0.508393  0.656240  1
  Sm  Sm128  1  0.020017  0.508393  0.656240  1
  Sm  Sm129  1  0.618512  0.848073  0.639868  1
  Sm  Sm130  1  0.707045  0.188723  0.631163  1
  Sm  Sm131  1  0.118512  0.848073  0.639868  1
  Sm  Sm132  1  0.207045  0.188723  0.631163  1
  Sm  Sm133  1  0.157191  0.314909  0.689189  1
  Sm  Sm134  1  0.657191  0.314909  0.689189  1
  Sm  Sm135  1  0.244757  0.679432  0.678096  1
  Sm  Sm136  1  0.108699  0.938657  0.700740  1
  Sm  Sm137  1  0.744757  0.679432  0.678096  1
  Sm  Sm138  1  0.608699  0.938657  0.700740  1
  Sm  Sm139  1  0.273614  0.480909  0.692181  1
  Sm  Sm140  1  0.773614  0.480909  0.692181  1
  Sm  Sm141  1  0.404808  0.814623  0.686881  1
  Sm  Sm142  1  0.475462  0.155452  0.678361  1
  Sm  Sm143  1  0.904808  0.814623  0.686881  1
  Sm  Sm144  1  0.975462  0.155452  0.678361  1
