# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.35882877
_cell_length_b   18.66027121
_cell_length_c   17.17751592
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm149
_cell_volume   5096.28743081
_cell_formula_units_Z   149
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  0.067621  0.091308  0.404479  1
  Sm  Sm2  1  0.067621  0.091308  0.751097  1
  Sm  Sm3  1  0.888171  0.262290  0.077788  1
  Sm  Sm4  1  0.865887  0.274600  0.414116  1
  Sm  Sm5  1  0.865887  0.274600  0.741459  1
  Sm  Sm6  1  0.673456  0.440275  0.077788  1
  Sm  Sm7  1  0.669047  0.443177  0.408012  1
  Sm  Sm8  1  0.669047  0.443177  0.747564  1
  Sm  Sm9  1  0.465697  0.654146  0.077788  1
  Sm  Sm10  1  0.469740  0.650083  0.409866  1
  Sm  Sm11  1  0.469740  0.650083  0.745709  1
  Sm  Sm12  1  0.255777  0.885684  0.077788  1
  Sm  Sm13  1  0.268684  0.865130  0.413204  1
  Sm  Sm14  1  0.268684  0.865130  0.742371  1
  Sm  Sm15  1  0.290035  0.055334  0.077788  1
  Sm  Sm16  1  0.266148  0.066528  0.403772  1
  Sm  Sm17  1  0.266148  0.066528  0.751803  1
  Sm  Sm18  1  0.072340  0.293378  0.077788  1
  Sm  Sm19  1  0.079764  0.278792  0.403914  1
  Sm  Sm20  1  0.079764  0.278792  0.751662  1
  Sm  Sm21  1  0.871070  0.471863  0.077788  1
  Sm  Sm22  1  0.879858  0.467768  0.412498  1
  Sm  Sm23  1  0.879858  0.467768  0.743078  1
  Sm  Sm24  1  0.670593  0.637841  0.077788  1
  Sm  Sm25  1  0.674479  0.637890  0.414960  1
  Sm  Sm26  1  0.674479  0.637890  0.740615  1
  Sm  Sm27  1  0.473974  0.842066  0.077788  1
  Sm  Sm28  1  0.470738  0.847379  0.412218  1
  Sm  Sm29  1  0.470738  0.847379  0.743357  1
  Sm  Sm30  1  0.480800  0.042224  0.077788  1
  Sm  Sm31  1  0.474918  0.041406  0.410468  1
  Sm  Sm32  1  0.474918  0.041406  0.745108  1
  Sm  Sm33  1  0.279086  0.254946  0.077788  1
  Sm  Sm34  1  0.283010  0.260079  0.419664  1
  Sm  Sm35  1  0.283010  0.260079  0.735912  1
  Sm  Sm36  1  0.081960  0.480567  0.077788  1
  Sm  Sm37  1  0.080452  0.480771  0.412092  1
  Sm  Sm38  1  0.080452  0.480771  0.743483  1
  Sm  Sm39  1  0.881100  0.664614  0.077788  1
  Sm  Sm40  1  0.879641  0.666688  0.410764  1
  Sm  Sm41  1  0.879641  0.666688  0.744811  1
  Sm  Sm42  1  0.678849  0.832100  0.077788  1
  Sm  Sm43  1  0.676132  0.833911  0.408266  1
  Sm  Sm44  1  0.676132  0.833911  0.747309  1
  Sm  Sm45  1  0.674874  0.035810  0.077788  1
  Sm  Sm46  1  0.675687  0.035131  0.412944  1
  Sm  Sm47  1  0.675687  0.035131  0.742632  1
  Sm  Sm48  1  0.476808  0.244249  0.077788  1
  Sm  Sm49  1  0.478227  0.242901  0.410214  1
  Sm  Sm50  1  0.478227  0.242901  0.745361  1
  Sm  Sm51  1  0.280442  0.459984  0.077788  1
  Sm  Sm52  1  0.279494  0.460590  0.409717  1
  Sm  Sm53  1  0.279494  0.460590  0.745859  1
  Sm  Sm54  1  0.077163  0.683964  0.077788  1
  Sm  Sm55  1  0.076066  0.684091  0.411753  1
  Sm  Sm56  1  0.076066  0.684091  0.743822  1
  Sm  Sm57  1  0.875426  0.865556  0.077788  1
  Sm  Sm58  1  0.875814  0.868680  0.409687  1
  Sm  Sm59  1  0.875814  0.868680  0.745889  1
  Sm  Sm60  1  0.864482  0.070885  0.077788  1
  Sm  Sm61  1  0.871780  0.073047  0.409185  1
  Sm  Sm62  1  0.871780  0.073047  0.746391  1
  Sm  Sm63  1  0.672970  0.240657  0.077788  1
  Sm  Sm64  1  0.670785  0.240763  0.411992  1
  Sm  Sm65  1  0.670785  0.240763  0.743584  1
  Sm  Sm66  1  0.474554  0.447298  0.077788  1
  Sm  Sm67  1  0.472688  0.448837  0.411334  1
  Sm  Sm68  1  0.472688  0.448837  0.744241  1
  Sm  Sm69  1  0.271550  0.668241  0.077788  1
  Sm  Sm70  1  0.272372  0.664863  0.410088  1
  Sm  Sm71  1  0.272372  0.664863  0.745487  1
  Sm  Sm72  1  0.067500  0.890747  0.077788  1
  Sm  Sm73  1  0.068860  0.888720  0.413697  1
  Sm  Sm74  1  0.068860  0.888720  0.741879  1
  Sm  Sm75  1  0.934785  0.121393  0.236788  1
  Sm  Sm76  1  0.933718  0.122537  0.577788  1
  Sm  Sm77  1  0.934785  0.121393  0.918788  1
  Sm  Sm78  1  0.736593  0.307580  0.241859  1
  Sm  Sm79  1  0.733292  0.310170  0.577788  1
  Sm  Sm80  1  0.736593  0.307580  0.913717  1
  Sm  Sm81  1  0.535954  0.534320  0.241483  1
  Sm  Sm82  1  0.537107  0.534521  0.577788  1
  Sm  Sm83  1  0.535954  0.534320  0.914093  1
  Sm  Sm84  1  0.337192  0.750311  0.241860  1
  Sm  Sm85  1  0.337216  0.749822  0.577788  1
  Sm  Sm86  1  0.337192  0.750311  0.913715  1
  Sm  Sm87  1  0.134354  0.952861  0.246778  1
  Sm  Sm88  1  0.134300  0.958443  0.577788  1
  Sm  Sm89  1  0.134354  0.952861  0.908798  1
  Sm  Sm90  1  0.132973  0.138911  0.207345  1
  Sm  Sm91  1  0.142851  0.148754  0.577788  1
  Sm  Sm92  1  0.132973  0.138911  0.948231  1
  Sm  Sm93  1  0.937358  0.321757  0.250040  1
  Sm  Sm94  1  0.944807  0.317079  0.577788  1
  Sm  Sm95  1  0.937358  0.321757  0.905536  1
  Sm  Sm96  1  0.742454  0.504218  0.246901  1
  Sm  Sm97  1  0.743234  0.501631  0.577788  1
  Sm  Sm98  1  0.742454  0.504218  0.908674  1
  Sm  Sm99  1  0.545838  0.726329  0.248165  1
  Sm  Sm100  1  0.540524  0.729397  0.577788  1
  Sm  Sm101  1  0.545838  0.726329  0.907410  1
  Sm  Sm102  1  0.342582  0.941422  0.247613  1
  Sm  Sm103  1  0.342173  0.945443  0.577788  1
  Sm  Sm104  1  0.342582  0.941422  0.907963  1
  Sm  Sm105  1  0.335460  0.146209  0.248418  1
  Sm  Sm106  1  0.342677  0.138862  0.577788  1
  Sm  Sm107  1  0.335460  0.146209  0.907157  1
  Sm  Sm108  1  0.144764  0.345247  0.248327  1
  Sm  Sm109  1  0.137309  0.349783  0.577788  1
  Sm  Sm110  1  0.144764  0.345247  0.907248  1
  Sm  Sm111  1  0.946810  0.514706  0.243822  1
  Sm  Sm112  1  0.940573  0.520605  0.577788  1
  Sm  Sm113  1  0.946810  0.514706  0.911753  1
  Sm  Sm114  1  0.745372  0.700237  0.243457  1
  Sm  Sm115  1  0.744950  0.701871  0.577788  1
  Sm  Sm116  1  0.745372  0.700237  0.912118  1
  Sm  Sm117  1  0.538329  0.928731  0.241740  1
  Sm  Sm118  1  0.547251  0.924228  0.577788  1
  Sm  Sm119  1  0.538329  0.928731  0.913835  1
  Sm  Sm120  1  0.534484  0.131779  0.245125  1
  Sm  Sm121  1  0.532757  0.133205  0.577788  1
  Sm  Sm122  1  0.534484  0.131779  0.910451  1
  Sm  Sm123  1  0.336360  0.347505  0.243862  1
  Sm  Sm124  1  0.336025  0.349814  0.577788  1
  Sm  Sm125  1  0.336360  0.347505  0.911714  1
  Sm  Sm126  1  0.138094  0.553744  0.244736  1
  Sm  Sm127  1  0.139554  0.551984  0.577788  1
  Sm  Sm128  1  0.138094  0.553744  0.910839  1
  Sm  Sm129  1  0.937625  0.720865  0.244419  1
  Sm  Sm130  1  0.941226  0.720140  0.577788  1
  Sm  Sm131  1  0.937625  0.720865  0.911156  1
  Sm  Sm132  1  0.736960  0.905904  0.243934  1
  Sm  Sm133  1  0.740715  0.903406  0.577788  1
  Sm  Sm134  1  0.736960  0.905904  0.911641  1
  Sm  Sm135  1  0.730807  0.109991  0.246786  1
  Sm  Sm136  1  0.733338  0.109794  0.577788  1
  Sm  Sm137  1  0.730807  0.109991  0.908790  1
  Sm  Sm138  1  0.532342  0.336275  0.244607  1
  Sm  Sm139  1  0.531871  0.335893  0.577788  1
  Sm  Sm140  1  0.532342  0.336275  0.910969  1
  Sm  Sm141  1  0.334585  0.552208  0.242905  1
  Sm  Sm142  1  0.335042  0.551585  0.577788  1
  Sm  Sm143  1  0.334585  0.552208  0.912671  1
  Sm  Sm144  1  0.133342  0.757478  0.245608  1
  Sm  Sm145  1  0.136297  0.757555  0.577788  1
  Sm  Sm146  1  0.133342  0.757478  0.909967  1
  Sm  Sm147  1  0.932242  0.924346  0.243827  1
  Sm  Sm148  1  0.931306  0.924342  0.577788  1
  Sm  Sm149  1  0.932242  0.924346  0.911749  1
