# generated using pymatgen
data_Sm3Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99171590
_cell_length_b   27.68637975
_cell_length_c   59.92098038
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3Al
_chemical_formula_sum   'Sm90 Al30'
_cell_volume   8281.23180943
_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  0.302208  0.443435  0.218409  1
  Sm  Sm2  1  0.302208  0.058928  0.265407  1
  Sm  Sm3  1  0.302208  0.830026  0.223704  1
  Sm  Sm4  1  0.302208  0.558967  0.246037  1
  Sm  Sm5  1  0.302208  0.323416  0.199010  1
  Sm  Sm6  1  0.302208  0.959843  0.223475  1
  Sm  Sm7  1  0.302208  0.648029  0.196349  1
  Sm  Sm8  1  0.302208  0.252434  0.246963  1
  Sm  Sm9  1  0.302208  0.894057  0.274687  1
  Sm  Sm10  1  0.802208  0.541376  0.202192  1
  Sm  Sm11  1  0.802208  0.156837  0.252427  1
  Sm  Sm12  1  0.802208  0.776825  0.265245  1
  Sm  Sm13  1  0.802208  0.270506  0.290598  1
  Sm  Sm14  1  0.802208  0.057346  0.214469  1
  Sm  Sm15  1  0.802208  0.648608  0.243762  1
  Sm  Sm16  1  0.802208  0.361914  0.246266  1
  Sm  Sm17  1  0.802208  0.988069  0.273562  1
  Sm  Sm18  1  0.802208  0.748312  0.203953  1
  Sm  Sm19  1  0.302208  0.262098  0.331858  1
  Sm  Sm20  1  0.302208  0.868385  0.351543  1
  Sm  Sm21  1  0.302208  0.659432  0.289408  1
  Sm  Sm22  1  0.302208  0.383522  0.339618  1
  Sm  Sm23  1  0.302208  0.175247  0.290637  1
  Sm  Sm24  1  0.302208  0.788104  0.303348  1
  Sm  Sm25  1  0.302208  0.458653  0.284730  1
  Sm  Sm26  1  0.302208  0.084594  0.328651  1
  Sm  Sm27  1  0.302208  0.698595  0.348984  1
  Sm  Sm28  1  0.802208  0.387742  0.305086  1
  Sm  Sm29  1  0.802208  1.004271  0.333533  1
  Sm  Sm30  1  0.802208  0.619013  0.340980  1
  Sm  Sm31  1  0.802208  0.095772  0.381824  1
  Sm  Sm32  1  0.802208  0.889049  0.314317  1
  Sm  Sm33  1  0.802208  0.489334  0.341967  1
  Sm  Sm34  1  0.802208  0.171282  0.332847  1
  Sm  Sm35  1  0.802208  0.778618  0.348033  1
  Sm  Sm36  1  0.802208  0.555513  0.289191  1
  Sm  Sm37  1  0.302208  0.050499  0.423190  1
  Sm  Sm38  1  0.302208  0.651215  0.438081  1
  Sm  Sm39  1  0.302208  0.454368  0.388720  1
  Sm  Sm40  1  0.302208  0.182463  0.425873  1
  Sm  Sm41  1  0.302208  0.989105  0.368805  1
  Sm  Sm42  1  0.302208  0.583121  0.383737  1
  Sm  Sm43  1  0.302208  0.300909  0.389797  1
  Sm  Sm44  1  0.302208  0.898036  0.412548  1
  Sm  Sm45  1  0.302208  0.499777  0.441399  1
  Sm  Sm46  1  0.802208  0.224808  0.385708  1
  Sm  Sm47  1  0.802208  0.825524  0.400599  1
  Sm  Sm48  1  0.802208  0.421655  0.435069  1
  Sm  Sm49  1  0.802208  0.886918  0.454984  1
  Sm  Sm50  1  0.802208  0.693560  0.397917  1
  Sm  Sm51  1  0.802208  0.292902  0.440052  1
  Sm  Sm52  1  0.802208  0.977987  0.411241  1
  Sm  Sm53  1  0.802208  0.575114  0.433993  1
  Sm  Sm54  1  0.802208  0.376246  0.382391  1
  Sm  Sm55  1  0.302208  0.871752  0.490256  1
  Sm  Sm56  1  0.302208  0.488281  0.518704  1
  Sm  Sm57  1  0.302208  0.257010  0.482810  1
  Sm  Sm58  1  0.302208  0.986974  0.509472  1
  Sm  Sm59  1  0.302208  0.780251  0.441966  1
  Sm  Sm60  1  0.302208  0.386688  0.481823  1
  Sm  Sm61  1  0.302208  0.097405  0.475756  1
  Sm  Sm62  1  0.302208  0.704740  0.490943  1
  Sm  Sm63  1  0.302208  0.320510  0.534599  1
  Sm  Sm64  1  0.802208  1.007638  0.472246  1
  Sm  Sm65  1  0.802208  0.613925  0.491931  1
  Sm  Sm66  1  0.802208  0.216591  0.534381  1
  Sm  Sm67  1  0.802208  0.700776  0.533152  1
  Sm  Sm68  1  0.802208  0.492501  0.484172  1
  Sm  Sm69  1  0.802208  0.087919  0.520441  1
  Sm  Sm70  1  0.802208  0.791429  0.495139  1
  Sm  Sm71  1  0.802208  0.417370  0.539060  1
  Sm  Sm72  1  0.802208  0.177427  0.474805  1
  Sm  Sm73  1  0.302208  0.719186  0.571362  1
  Sm  Sm74  1  0.302208  0.334647  0.621597  1
  Sm  Sm75  1  0.302208  0.099198  0.558544  1
  Sm  Sm76  1  0.302208  0.818677  0.609321  1
  Sm  Sm77  1  0.302208  0.605517  0.533191  1
  Sm  Sm78  1  0.302208  0.227415  0.580028  1
  Sm  Sm79  1  0.302208  0.887954  0.550227  1
  Sm  Sm80  1  0.302208  0.514109  0.577523  1
  Sm  Sm81  1  0.302208  0.127711  0.619837  1
  Sm  Sm82  1  0.802208  0.817095  0.558382  1
  Sm  Sm83  1  0.802208  0.432588  0.605380  1
  Sm  Sm84  1  0.802208  0.045997  0.600085  1
  Sm  Sm85  1  0.802208  0.552607  0.624780  1
  Sm  Sm86  1  0.802208  0.317056  0.577752  1
  Sm  Sm87  1  0.802208  0.916180  0.600315  1
  Sm  Sm88  1  0.802208  0.623589  0.576827  1
  Sm  Sm89  1  0.802208  0.227993  0.627440  1
  Sm  Sm90  1  0.802208  0.981966  0.549102  1
  Al  Al91  1  0.802208  0.477265  0.250115  1
  Al  Al92  1  0.802208  0.260023  0.218608  1
  Al  Al93  1  0.802208  0.891183  0.243495  1
  Al  Al94  1  0.302208  0.338406  0.282932  1
  Al  Al95  1  0.302208  0.135679  0.225465  1
  Al  Al96  1  0.302208  0.720090  0.241210  1
  Al  Al97  1  0.802208  0.306005  0.346021  1
  Al  Al98  1  0.802208  0.092096  0.295602  1
  Al  Al99  1  0.802208  0.709157  0.308655  1
  Al  Al100  1  0.302208  0.169377  0.367960  1
  Al  Al101  1  0.302208  0.972797  0.309654  1
  Al  Al102  1  0.302208  0.557477  0.323354  1
  Al  Al103  1  0.802208  0.103132  0.437308  1
  Al  Al104  1  0.802208  0.916092  0.369141  1
  Al  Al105  1  0.802208  0.509919  0.394834  1
  Al  Al106  1  0.302208  0.959931  0.454648  1
  Al  Al107  1  0.302208  0.772891  0.386481  1
  Al  Al108  1  0.302208  0.366104  0.428956  1
  Al  Al109  1  0.802208  0.903225  0.514135  1
  Al  Al110  1  0.802208  0.706646  0.455829  1
  Al  Al111  1  0.802208  0.318545  0.500435  1
  Al  Al112  1  0.302208  0.783927  0.528187  1
  Al  Al113  1  0.302208  0.570018  0.477769  1
  Al  Al114  1  0.302208  0.166865  0.515134  1
  Al  Al115  1  0.802208  0.740344  0.598325  1
  Al  Al116  1  0.802208  0.537617  0.540857  1
  Al  Al117  1  0.802208  0.155933  0.582579  1
  Al  Al118  1  0.302208  0.616000  0.605181  1
  Al  Al119  1  0.302208  0.398758  0.573675  1
  Al  Al120  1  0.302208  0.984840  0.580294  1
