# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   26.48211724
_cell_length_b   15.33283198
_cell_length_c   51.78195835
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm270
_cell_volume   21025.8495068
_cell_formula_units_Z   270
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  0.365033  0.884431  0.283252  1
  Sm  Sm2  1  0.361561  0.674411  0.252175  1
  Sm  Sm3  1  0.359972  0.279419  0.266138  1
  Sm  Sm4  1  0.244474  0.128645  0.275712  1
  Sm  Sm5  1  0.253275  0.907317  0.247867  1
  Sm  Sm6  1  0.247097  0.519134  0.261574  1
  Sm  Sm7  1  0.135159  0.972648  0.287211  1
  Sm  Sm8  1  0.135633  0.761386  0.256532  1
  Sm  Sm9  1  0.132173  0.364258  0.270662  1
  Sm  Sm10  1  0.023972  0.986995  0.250374  1
  Sm  Sm11  1  0.021188  0.603584  0.264894  1
  Sm  Sm12  1  0.016064  0.211058  0.279123  1
  Sm  Sm13  1  0.908268  0.046654  0.287843  1
  Sm  Sm14  1  0.917287  0.819541  0.252971  1
  Sm  Sm15  1  0.911973  0.437376  0.270296  1
  Sm  Sm16  1  0.804378  0.210785  0.270733  1
  Sm  Sm17  1  0.807377  0.985156  0.243235  1
  Sm  Sm18  1  0.806716  0.605871  0.256977  1
  Sm  Sm19  1  0.683717  0.051558  0.278962  1
  Sm  Sm20  1  0.697665  0.828708  0.251844  1
  Sm  Sm21  1  0.691432  0.443583  0.265680  1
  Sm  Sm22  1  0.580014  0.884091  0.288554  1
  Sm  Sm23  1  0.586807  0.660462  0.255236  1
  Sm  Sm24  1  0.580923  0.278679  0.272911  1
  Sm  Sm25  1  0.475770  0.046817  0.271049  1
  Sm  Sm26  1  0.478649  0.821649  0.243450  1
  Sm  Sm27  1  0.474998  0.442312  0.257260  1
  Sm  Sm28  1  0.357609  0.686073  0.328499  1
  Sm  Sm29  1  0.361798  0.485295  0.298481  1
  Sm  Sm30  1  0.357784  0.086343  0.311624  1
  Sm  Sm31  1  0.244158  0.932107  0.322112  1
  Sm  Sm32  1  0.248935  0.727379  0.293770  1
  Sm  Sm33  1  0.246435  0.332080  0.307948  1
  Sm  Sm34  1  0.130210  0.776538  0.332385  1
  Sm  Sm35  1  0.134358  0.573889  0.302649  1
  Sm  Sm36  1  0.130905  0.177402  0.316785  1
  Sm  Sm37  1  0.020151  0.815443  0.297721  1
  Sm  Sm38  1  0.019056  0.421154  0.312120  1
  Sm  Sm39  1  0.016923  1.024545  0.326451  1
  Sm  Sm40  1  0.904349  0.863732  0.334749  1
  Sm  Sm41  1  0.909057  0.653587  0.304533  1
  Sm  Sm42  1  0.906266  0.260753  0.319483  1
  Sm  Sm43  1  0.794397  1.014147  0.317155  1
  Sm  Sm44  1  0.805565  0.809326  0.290148  1
  Sm  Sm45  1  0.800458  0.413795  0.303978  1
  Sm  Sm46  1  0.685998  0.857697  0.327512  1
  Sm  Sm47  1  0.691619  0.652215  0.298428  1
  Sm  Sm48  1  0.689769  0.255108  0.312614  1
  Sm  Sm49  1  0.574164  0.696684  0.335569  1
  Sm  Sm50  1  0.578578  0.490405  0.305567  1
  Sm  Sm51  1  0.574412  0.095250  0.320879  1
  Sm  Sm52  1  0.469125  0.845472  0.318765  1
  Sm  Sm53  1  0.473448  0.644753  0.290022  1
  Sm  Sm54  1  0.469186  0.246666  0.304472  1
  Sm  Sm55  1  0.349817  0.484312  0.372268  1
  Sm  Sm56  1  0.354283  0.284583  0.342893  1
  Sm  Sm57  1  0.351337  0.885164  0.357216  1
  Sm  Sm58  1  0.236862  0.731101  0.367008  1
  Sm  Sm59  1  0.242489  0.531376  0.338094  1
  Sm  Sm60  1  0.238746  0.130290  0.351770  1
  Sm  Sm61  1  0.122367  0.575872  0.376429  1
  Sm  Sm62  1  0.127798  0.376697  0.347376  1
  Sm  Sm63  1  0.124308  0.975703  0.361361  1
  Sm  Sm64  1  0.015284  0.623481  0.342317  1
  Sm  Sm65  1  0.012089  0.223487  0.356482  1
  Sm  Sm66  1  0.009231  0.823551  0.371017  1
  Sm  Sm67  1  0.897239  0.666371  0.380003  1
  Sm  Sm68  1  0.902358  0.464184  0.350188  1
  Sm  Sm69  1  0.899273  0.064787  0.364609  1
  Sm  Sm70  1  0.792068  0.809683  0.361803  1
  Sm  Sm71  1  0.797351  0.610290  0.333674  1
  Sm  Sm72  1  0.795692  0.209503  0.347384  1
  Sm  Sm73  1  0.679011  0.655839  0.371719  1
  Sm  Sm74  1  0.684689  0.455857  0.342904  1
  Sm  Sm75  1  0.681208  0.055896  0.356709  1
  Sm  Sm76  1  0.567060  0.498705  0.380910  1
  Sm  Sm77  1  0.572073  0.297869  0.351195  1
  Sm  Sm78  1  0.568772  0.897928  0.365662  1
  Sm  Sm79  1  0.462627  0.640805  0.362603  1
  Sm  Sm80  1  0.467298  0.442150  0.333667  1
  Sm  Sm81  1  0.462847  0.040965  0.347231  1
  Sm  Sm82  1  0.343112  0.284876  0.416889  1
  Sm  Sm83  1  0.346818  0.084697  0.386744  1
  Sm  Sm84  1  0.345142  0.684922  0.402082  1
  Sm  Sm85  1  0.229934  0.531232  0.411708  1
  Sm  Sm86  1  0.234687  0.330108  0.381838  1
  Sm  Sm87  1  0.231893  0.931168  0.396684  1
  Sm  Sm88  1  0.115330  0.376645  0.421060  1
  Sm  Sm89  1  0.119709  0.175782  0.390943  1
  Sm  Sm90  1  0.117319  0.776557  0.406130  1
  Sm  Sm91  1  0.007080  0.422882  0.385952  1
  Sm  Sm92  1  0.004445  1.023295  0.400728  1
  Sm  Sm93  1  0.002294  0.623569  0.415738  1
  Sm  Sm94  1  0.890007  0.467577  0.424728  1
  Sm  Sm95  1  0.895022  0.266085  0.394897  1
  Sm  Sm96  1  0.892129  0.867343  0.409700  1
  Sm  Sm97  1  0.785169  0.609335  0.406717  1
  Sm  Sm98  1  0.790349  0.407791  0.376881  1
  Sm  Sm99  1  0.787213  1.009033  0.391514  1
  Sm  Sm100  1  0.672667  0.454631  0.416305  1
  Sm  Sm101  1  0.677360  0.254398  0.386544  1
  Sm  Sm102  1  0.674496  0.854930  0.401440  1
  Sm  Sm103  1  0.559926  0.299203  0.425606  1
  Sm  Sm104  1  0.564197  0.098459  0.395674  1
  Sm  Sm105  1  0.561988  0.699258  0.410631  1
  Sm  Sm106  1  0.455345  0.440773  0.407487  1
  Sm  Sm107  1  0.459988  0.239888  0.377515  1
  Sm  Sm108  1  0.457130  0.840723  0.392534  1
  Sm  Sm109  1  0.335929  0.085539  0.461382  1
  Sm  Sm110  1  0.340480  0.885405  0.431736  1
  Sm  Sm111  1  0.338500  0.485471  0.446638  1
  Sm  Sm112  1  0.223307  0.332012  0.456234  1
  Sm  Sm113  1  0.227560  0.131649  0.426405  1
  Sm  Sm114  1  0.225390  0.732059  0.441437  1
  Sm  Sm115  1  0.108424  0.177652  0.465579  1
  Sm  Sm116  1  0.112822  0.977364  0.435894  1
  Sm  Sm117  1  0.110676  0.577623  0.450765  1
  Sm  Sm118  1  0.000230  0.223693  0.430585  1
  Sm  Sm119  1  0.997498  0.824220  0.445435  1
  Sm  Sm120  1  0.995412  0.424239  0.460249  1
  Sm  Sm121  1  0.883211  0.268406  0.469544  1
  Sm  Sm122  1  0.887713  0.067794  0.439711  1
  Sm  Sm123  1  0.885283  0.668389  0.454613  1
  Sm  Sm124  1  0.778521  0.409794  0.451414  1
  Sm  Sm125  1  0.783160  0.209273  0.421572  1
  Sm  Sm126  1  0.780579  0.809880  0.436488  1
  Sm  Sm127  1  0.665880  0.254894  0.460902  1
  Sm  Sm128  1  0.670195  0.054893  0.431057  1
  Sm  Sm129  1  0.667863  0.654983  0.446002  1
  Sm  Sm130  1  0.552997  0.099942  0.470445  1
  Sm  Sm131  1  0.557307  0.899726  0.440467  1
  Sm  Sm132  1  0.555325  0.499764  0.455458  1
  Sm  Sm133  1  0.448437  0.241181  0.452200  1
  Sm  Sm134  1  0.452596  0.041090  0.422144  1
  Sm  Sm135  1  0.450697  0.641248  0.437330  1
  Sm  Sm136  1  0.328815  0.886322  0.506090  1
  Sm  Sm137  1  0.333633  0.685777  0.476426  1
  Sm  Sm138  1  0.331547  0.285795  0.491240  1
  Sm  Sm139  1  0.216223  0.132652  0.500781  1
  Sm  Sm140  1  0.220621  0.932363  0.471096  1
  Sm  Sm141  1  0.218369  0.532392  0.485910  1
  Sm  Sm142  1  0.101485  0.978366  0.510270  1
  Sm  Sm143  1  0.105738  0.778003  0.480441  1
  Sm  Sm144  1  0.103655  0.377956  0.495238  1
  Sm  Sm145  1  0.993116  1.024476  0.475293  1
  Sm  Sm146  1  0.990545  0.624544  0.490037  1
  Sm  Sm147  1  0.988564  0.224611  0.504939  1
  Sm  Sm148  1  0.876449  0.068925  0.514531  1
  Sm  Sm149  1  0.880608  0.868834  0.484474  1
  Sm  Sm150  1  0.878347  0.468767  0.499345  1
  Sm  Sm151  1  0.771737  0.210289  0.496208  1
  Sm  Sm152  1  0.776047  1.010073  0.466230  1
  Sm  Sm153  1  0.773719  0.610251  0.481217  1
  Sm  Sm154  1  0.658850  0.055122  0.505618  1
  Sm  Sm155  1  0.663164  0.855121  0.475773  1
  Sm  Sm156  1  0.661182  0.455032  0.490673  1
  Sm  Sm157  1  0.545885  0.900742  0.515103  1
  Sm  Sm158  1  0.550524  0.700221  0.485261  1
  Sm  Sm159  1  0.548466  0.300135  0.500187  1
  Sm  Sm160  1  0.441332  0.042221  0.496964  1
  Sm  Sm161  1  0.445834  0.841610  0.467131  1
  Sm  Sm162  1  0.443761  0.441626  0.482062  1
  Sm  Sm163  1  0.321964  0.687133  0.550723  1
  Sm  Sm164  1  0.326751  0.486447  0.520937  1
  Sm  Sm165  1  0.324600  0.086720  0.535947  1
  Sm  Sm166  1  0.209336  0.934233  0.545732  1
  Sm  Sm167  1  0.213715  0.733370  0.515615  1
  Sm  Sm168  1  0.211725  0.333458  0.530545  1
  Sm  Sm169  1  0.094357  0.779907  0.554837  1
  Sm  Sm170  1  0.099111  0.578783  0.524967  1
  Sm  Sm171  1  0.097152  0.178848  0.539991  1
  Sm  Sm172  1  0.985933  0.825140  0.519786  1
  Sm  Sm173  1  0.983902  0.425094  0.534593  1
  Sm  Sm174  1  0.982226  1.025318  0.549931  1
  Sm  Sm175  1  0.869057  0.870127  0.559160  1
  Sm  Sm176  1  0.873700  0.669242  0.529188  1
  Sm  Sm177  1  0.871914  0.269292  0.544141  1
  Sm  Sm178  1  0.764848  1.011556  0.541001  1
  Sm  Sm179  1  0.769118  0.810813  0.511069  1
  Sm  Sm180  1  0.767056  0.410757  0.526044  1
  Sm  Sm181  1  0.651684  0.855617  0.550131  1
  Sm  Sm182  1  0.656378  0.655384  0.520370  1
  Sm  Sm183  1  0.654548  0.255086  0.535235  1
  Sm  Sm184  1  0.538695  0.702224  0.559794  1
  Sm  Sm185  1  0.543875  0.500680  0.529958  1
  Sm  Sm186  1  0.541832  0.100982  0.545161  1
  Sm  Sm187  1  0.434023  0.843930  0.541778  1
  Sm  Sm188  1  0.439037  0.642439  0.511947  1
  Sm  Sm189  1  0.436916  0.242673  0.526975  1
  Sm  Sm190  1  0.313760  0.486534  0.594358  1
  Sm  Sm191  1  0.319813  0.286464  0.565658  1
  Sm  Sm192  1  0.316955  0.886528  0.580193  1
  Sm  Sm193  1  0.201247  0.733319  0.589299  1
  Sm  Sm194  1  0.206678  0.534143  0.560246  1
  Sm  Sm195  1  0.204736  0.134312  0.575314  1
  Sm  Sm196  1  0.086555  0.578639  0.598581  1
  Sm  Sm197  1  0.092182  0.378914  0.569667  1
  Sm  Sm198  1  0.090298  0.979725  0.584905  1
  Sm  Sm199  1  0.979227  0.625703  0.564407  1
  Sm  Sm200  1  0.977707  0.224851  0.579459  1
  Sm  Sm201  1  0.974761  0.825432  0.593782  1
  Sm  Sm202  1  0.861746  0.667865  0.603008  1
  Sm  Sm203  1  0.866417  0.469211  0.574072  1
  Sm  Sm204  1  0.866197  0.069050  0.589444  1
  Sm  Sm205  1  0.756972  0.812147  0.585480  1
  Sm  Sm206  1  0.761984  0.611311  0.555765  1
  Sm  Sm207  1  0.760273  0.212087  0.571013  1
  Sm  Sm208  1  0.644356  0.654159  0.593770  1
  Sm  Sm209  1  0.650034  0.454176  0.564956  1
  Sm  Sm210  1  0.647836  0.054119  0.579966  1
  Sm  Sm211  1  0.531694  0.499725  0.603001  1
  Sm  Sm212  1  0.536976  0.300332  0.574872  1
  Sm  Sm213  1  0.533352  0.900512  0.589291  1
  Sm  Sm214  1  0.426687  0.645831  0.586487  1
  Sm  Sm215  1  0.431805  0.443644  0.556672  1
  Sm  Sm216  1  0.429772  0.045228  0.572066  1
  Sm  Sm217  1  0.308894  0.294572  0.638954  1
  Sm  Sm218  1  0.312122  0.085470  0.610224  1
  Sm  Sm219  1  0.309989  0.688862  0.624555  1
  Sm  Sm220  1  0.194686  0.536126  0.634026  1
  Sm  Sm221  1  0.198835  0.333477  0.604290  1
  Sm  Sm222  1  0.198140  0.932614  0.619890  1
  Sm  Sm223  1  0.080110  0.382636  0.642905  1
  Sm  Sm224  1  0.084886  0.177908  0.614563  1
  Sm  Sm225  1  0.082610  0.777936  0.628727  1
  Sm  Sm226  1  0.971435  0.423943  0.608176  1
  Sm  Sm227  1  0.971260  1.023673  0.625051  1
  Sm  Sm228  1  0.967246  0.624720  0.638194  1
  Sm  Sm229  1  0.855597  0.465262  0.646653  1
  Sm  Sm230  1  0.859919  0.264543  0.617910  1
  Sm  Sm231  1  0.859858  0.863349  0.632203  1
  Sm  Sm232  1  0.750467  0.619610  0.631108  1
  Sm  Sm233  1  0.754881  0.413332  0.601106  1
  Sm  Sm234  1  0.754633  1.014765  0.615796  1
  Sm  Sm235  1  0.637426  0.457800  0.638247  1
  Sm  Sm236  1  0.643046  0.252318  0.609163  1
  Sm  Sm237  1  0.639276  0.854907  0.624061  1
  Sm  Sm238  1  0.523479  0.300689  0.646527  1
  Sm  Sm239  1  0.534647  0.095869  0.619520  1
  Sm  Sm240  1  0.528587  0.696221  0.632697  1
  Sm  Sm241  1  0.419988  0.456428  0.632142  1
  Sm  Sm242  1  0.424696  0.246283  0.601926  1
  Sm  Sm243  1  0.422778  0.849262  0.617192  1
  Sm  Sm244  1  0.305073  0.123021  0.686301  1
  Sm  Sm245  1  0.312980  0.898957  0.657552  1
  Sm  Sm246  1  0.307857  0.506431  0.671781  1
  Sm  Sm247  1  0.193412  0.348629  0.680143  1
  Sm  Sm248  1  0.193886  0.137367  0.649464  1
  Sm  Sm249  1  0.196871  0.745757  0.666013  1
  Sm  Sm250  1  0.075770  0.202699  0.688808  1
  Sm  Sm251  1  0.084570  0.981371  0.660963  1
  Sm  Sm252  1  0.081948  0.590881  0.675101  1
  Sm  Sm253  1  0.964011  0.225584  0.653422  1
  Sm  Sm254  1  0.969073  0.830597  0.670537  1
  Sm  Sm255  1  0.967484  0.435604  0.684500  1
  Sm  Sm256  1  0.850395  0.288366  0.693225  1
  Sm  Sm257  1  0.853274  0.063198  0.665626  1
  Sm  Sm258  1  0.854046  0.667704  0.679415  1
  Sm  Sm259  1  0.742238  0.449554  0.681439  1
  Sm  Sm260  1  0.749031  0.225924  0.648121  1
  Sm  Sm261  1  0.748122  0.831336  0.663764  1
  Sm  Sm262  1  0.631379  0.281308  0.684831  1
  Sm  Sm263  1  0.645327  0.058457  0.657713  1
  Sm  Sm264  1  0.637612  0.666432  0.670995  1
  Sm  Sm265  1  0.521668  0.124859  0.693440  1
  Sm  Sm266  1  0.524667  0.899231  0.665942  1
  Sm  Sm267  1  0.522329  0.504145  0.679698  1
  Sm  Sm268  1  0.411758  0.290474  0.683704  1
  Sm  Sm269  1  0.420777  0.063361  0.648832  1
  Sm  Sm270  1  0.417072  0.672639  0.666379  1
