# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   31.55961392
_cell_length_b   19.07496751
_cell_length_c   47.77786495
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   55.14033191
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm288
_cell_volume   23600.9571554
_cell_formula_units_Z   288
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  0.760783  0.389220  0.299613  1
  Sm  Sm2  1  0.706402  0.608162  0.326995  1
  Sm  Sm3  1  0.760783  0.722554  0.299613  1
  Sm  Sm4  1  0.260783  0.389220  0.299613  1
  Sm  Sm5  1  0.706402  0.941496  0.326995  1
  Sm  Sm6  1  0.206402  0.608162  0.326995  1
  Sm  Sm7  1  0.760783  0.055887  0.299613  1
  Sm  Sm8  1  0.260783  0.722554  0.299613  1
  Sm  Sm9  1  0.706402  0.274829  0.326995  1
  Sm  Sm10  1  0.206402  0.941496  0.326995  1
  Sm  Sm11  1  0.260783  0.055887  0.299613  1
  Sm  Sm12  1  0.206402  0.274829  0.326995  1
  Sm  Sm13  1  0.484578  0.661815  0.316834  1
  Sm  Sm14  1  0.550904  0.755944  0.286301  1
  Sm  Sm15  1  0.484578  0.995148  0.316834  1
  Sm  Sm16  1  0.984578  0.661815  0.316834  1
  Sm  Sm17  1  0.550904  0.089278  0.286301  1
  Sm  Sm18  1  0.050904  0.755944  0.286301  1
  Sm  Sm19  1  0.484578  0.328482  0.316834  1
  Sm  Sm20  1  0.984578  0.995148  0.316834  1
  Sm  Sm21  1  0.550904  0.422611  0.286301  1
  Sm  Sm22  1  0.050904  0.089278  0.286301  1
  Sm  Sm23  1  0.984578  0.328482  0.316834  1
  Sm  Sm24  1  0.050904  0.422611  0.286301  1
  Sm  Sm25  1  0.352334  0.826783  0.314987  1
  Sm  Sm26  1  0.405048  0.933820  0.283136  1
  Sm  Sm27  1  0.352334  0.160117  0.314987  1
  Sm  Sm28  1  0.852334  0.826783  0.314987  1
  Sm  Sm29  1  0.405048  0.267153  0.283136  1
  Sm  Sm30  1  0.905048  0.933820  0.283136  1
  Sm  Sm31  1  0.352334  0.493450  0.314987  1
  Sm  Sm32  1  0.852334  0.160117  0.314987  1
  Sm  Sm33  1  0.405048  0.600486  0.283136  1
  Sm  Sm34  1  0.905048  0.267153  0.283136  1
  Sm  Sm35  1  0.852334  0.493450  0.314987  1
  Sm  Sm36  1  0.905048  0.600486  0.283136  1
  Sm  Sm37  1  0.618673  0.507957  0.312202  1
  Sm  Sm38  1  0.583867  0.696408  0.355227  1
  Sm  Sm39  1  0.618673  0.841290  0.312202  1
  Sm  Sm40  1  0.118673  0.507957  0.312202  1
  Sm  Sm41  1  0.583867  0.029742  0.355227  1
  Sm  Sm42  1  0.083867  0.696408  0.355227  1
  Sm  Sm43  1  0.618673  0.174623  0.312202  1
  Sm  Sm44  1  0.118673  0.841290  0.312202  1
  Sm  Sm45  1  0.583867  0.363075  0.355227  1
  Sm  Sm46  1  0.083867  0.029742  0.355227  1
  Sm  Sm47  1  0.118673  0.174623  0.312202  1
  Sm  Sm48  1  0.083867  0.363075  0.355227  1
  Sm  Sm49  1  0.694152  0.465825  0.372207  1
  Sm  Sm50  1  0.664737  0.671422  0.407619  1
  Sm  Sm51  1  0.694152  0.799158  0.372207  1
  Sm  Sm52  1  0.194152  0.465825  0.372207  1
  Sm  Sm53  1  0.664737  1.004755  0.407619  1
  Sm  Sm54  1  0.164737  0.671422  0.407619  1
  Sm  Sm55  1  0.694152  0.132491  0.372207  1
  Sm  Sm56  1  0.194152  0.799158  0.372207  1
  Sm  Sm57  1  0.664737  0.338088  0.407619  1
  Sm  Sm58  1  0.164737  1.004755  0.407619  1
  Sm  Sm59  1  0.194152  0.132491  0.372207  1
  Sm  Sm60  1  0.164737  0.338088  0.407619  1
  Sm  Sm61  1  0.424058  0.739526  0.388646  1
  Sm  Sm62  1  0.458042  0.857631  0.353294  1
  Sm  Sm63  1  0.424058  0.072859  0.388646  1
  Sm  Sm64  1  0.924058  0.739526  0.388646  1
  Sm  Sm65  1  0.458042  0.190965  0.353294  1
  Sm  Sm66  1  0.958042  0.857631  0.353294  1
  Sm  Sm67  1  0.424058  0.406192  0.388646  1
  Sm  Sm68  1  0.924058  0.072859  0.388646  1
  Sm  Sm69  1  0.458042  0.524298  0.353294  1
  Sm  Sm70  1  0.958042  0.190965  0.353294  1
  Sm  Sm71  1  0.924058  0.406192  0.388646  1
  Sm  Sm72  1  0.958042  0.524298  0.353294  1
  Sm  Sm73  1  0.297815  0.909845  0.386429  1
  Sm  Sm74  1  0.334760  0.032378  0.355346  1
  Sm  Sm75  1  0.297815  0.243179  0.386429  1
  Sm  Sm76  1  0.797815  0.909845  0.386429  1
  Sm  Sm77  1  0.334760  0.365711  0.355346  1
  Sm  Sm78  1  0.834760  0.032378  0.355346  1
  Sm  Sm79  1  0.297815  0.576512  0.386429  1
  Sm  Sm80  1  0.797815  0.243179  0.386429  1
  Sm  Sm81  1  0.334760  0.699045  0.355346  1
  Sm  Sm82  1  0.834760  0.365711  0.355346  1
  Sm  Sm83  1  0.797815  0.576512  0.386429  1
  Sm  Sm84  1  0.834760  0.699045  0.355346  1
  Sm  Sm85  1  0.551276  0.566774  0.387136  1
  Sm  Sm86  1  0.522526  0.773654  0.424312  1
  Sm  Sm87  1  0.551276  0.900108  0.387136  1
  Sm  Sm88  1  0.051276  0.566774  0.387136  1
  Sm  Sm89  1  0.522526  0.106987  0.424312  1
  Sm  Sm90  1  0.022526  0.773654  0.424312  1
  Sm  Sm91  1  0.551276  0.233441  0.387136  1
  Sm  Sm92  1  0.051276  0.900108  0.387136  1
  Sm  Sm93  1  0.522526  0.440321  0.424312  1
  Sm  Sm94  1  0.022526  0.106987  0.424312  1
  Sm  Sm95  1  0.051276  0.233441  0.387136  1
  Sm  Sm96  1  0.022526  0.440321  0.424312  1
  Sm  Sm97  1  0.629075  0.550812  0.442005  1
  Sm  Sm98  1  0.599803  0.757477  0.478765  1
  Sm  Sm99  1  0.629075  0.884145  0.442005  1
  Sm  Sm100  1  0.129075  0.550812  0.442005  1
  Sm  Sm101  1  0.599803  0.090810  0.478765  1
  Sm  Sm102  1  0.099803  0.757477  0.478765  1
  Sm  Sm103  1  0.629075  0.217478  0.442005  1
  Sm  Sm104  1  0.129075  0.884145  0.442005  1
  Sm  Sm105  1  0.599803  0.424143  0.478765  1
  Sm  Sm106  1  0.099803  0.090810  0.478765  1
  Sm  Sm107  1  0.129075  0.217478  0.442005  1
  Sm  Sm108  1  0.099803  0.424143  0.478765  1
  Sm  Sm109  1  0.363485  0.819453  0.460642  1
  Sm  Sm110  1  0.397219  0.940110  0.425134  1
  Sm  Sm111  1  0.363485  0.152787  0.460642  1
  Sm  Sm112  1  0.863485  0.819453  0.460642  1
  Sm  Sm113  1  0.397219  0.273443  0.425134  1
  Sm  Sm114  1  0.897219  0.940110  0.425134  1
  Sm  Sm115  1  0.363485  0.486120  0.460642  1
  Sm  Sm116  1  0.863485  0.152787  0.460642  1
  Sm  Sm117  1  0.397219  0.606776  0.425134  1
  Sm  Sm118  1  0.897219  0.273443  0.425134  1
  Sm  Sm119  1  0.863485  0.486120  0.460642  1
  Sm  Sm120  1  0.897219  0.606776  0.425134  1
  Sm  Sm121  1  0.238849  0.989723  0.461099  1
  Sm  Sm122  1  0.271560  0.112226  0.426656  1
  Sm  Sm123  1  0.238849  0.323057  0.461099  1
  Sm  Sm124  1  0.738849  0.989723  0.461099  1
  Sm  Sm125  1  0.271560  0.445559  0.426656  1
  Sm  Sm126  1  0.771560  0.112226  0.426656  1
  Sm  Sm127  1  0.238849  0.656390  0.461099  1
  Sm  Sm128  1  0.738849  0.323057  0.461099  1
  Sm  Sm129  1  0.271560  0.778892  0.426656  1
  Sm  Sm130  1  0.771560  0.445559  0.426656  1
  Sm  Sm131  1  0.738849  0.656390  0.461099  1
  Sm  Sm132  1  0.771560  0.778892  0.426656  1
  Sm  Sm133  1  0.489288  0.649370  0.459144  1
  Sm  Sm134  1  0.459056  0.856464  0.495752  1
  Sm  Sm135  1  0.489288  0.982703  0.459144  1
  Sm  Sm136  1  0.989288  0.649370  0.459144  1
  Sm  Sm137  1  0.459056  0.189797  0.495752  1
  Sm  Sm138  1  0.959056  0.856464  0.495752  1
  Sm  Sm139  1  0.489288  0.316036  0.459144  1
  Sm  Sm140  1  0.989288  0.982703  0.459144  1
  Sm  Sm141  1  0.459056  0.523131  0.495752  1
  Sm  Sm142  1  0.959056  0.189797  0.495752  1
  Sm  Sm143  1  0.989288  0.316036  0.459144  1
  Sm  Sm144  1  0.959056  0.523131  0.495752  1
  Sm  Sm145  1  0.566614  0.633376  0.513709  1
  Sm  Sm146  1  0.536840  0.840978  0.550063  1
  Sm  Sm147  1  0.566614  0.966709  0.513709  1
  Sm  Sm148  1  0.066614  0.633376  0.513709  1
  Sm  Sm149  1  0.536840  0.174312  0.550063  1
  Sm  Sm150  1  0.036840  0.840978  0.550063  1
  Sm  Sm151  1  0.566614  0.300043  0.513709  1
  Sm  Sm152  1  0.066614  0.966709  0.513709  1
  Sm  Sm153  1  0.536840  0.507645  0.550063  1
  Sm  Sm154  1  0.036840  0.174312  0.550063  1
  Sm  Sm155  1  0.066614  0.300043  0.513709  1
  Sm  Sm156  1  0.036840  0.507645  0.550063  1
  Sm  Sm157  1  0.301349  0.900249  0.532434  1
  Sm  Sm158  1  0.332687  0.026307  0.496594  1
  Sm  Sm159  1  0.301349  0.233582  0.532434  1
  Sm  Sm160  1  0.801349  0.900249  0.532434  1
  Sm  Sm161  1  0.332687  0.359640  0.496594  1
  Sm  Sm162  1  0.832687  0.026307  0.496594  1
  Sm  Sm163  1  0.301349  0.566915  0.532434  1
  Sm  Sm164  1  0.801349  0.233582  0.532434  1
  Sm  Sm165  1  0.332687  0.692974  0.496594  1
  Sm  Sm166  1  0.832687  0.359640  0.496594  1
  Sm  Sm167  1  0.801349  0.566915  0.532434  1
  Sm  Sm168  1  0.832687  0.692974  0.496594  1
  Sm  Sm169  1  0.176151  0.072409  0.533287  1
  Sm  Sm170  1  0.206675  0.198482  0.497007  1
  Sm  Sm171  1  0.176151  0.405743  0.533287  1
  Sm  Sm172  1  0.676151  0.072409  0.533287  1
  Sm  Sm173  1  0.206675  0.531815  0.497007  1
  Sm  Sm174  1  0.706675  0.198482  0.497007  1
  Sm  Sm175  1  0.176151  0.739076  0.533287  1
  Sm  Sm176  1  0.676151  0.405743  0.533287  1
  Sm  Sm177  1  0.206675  0.865149  0.497007  1
  Sm  Sm178  1  0.706675  0.531815  0.497007  1
  Sm  Sm179  1  0.676151  0.739076  0.533287  1
  Sm  Sm180  1  0.706675  0.865149  0.497007  1
  Sm  Sm181  1  0.427094  0.731338  0.531444  1
  Sm  Sm182  1  0.394801  0.940085  0.566548  1
  Sm  Sm183  1  0.427094  0.064671  0.531444  1
  Sm  Sm184  1  0.927094  0.731338  0.531444  1
  Sm  Sm185  1  0.394801  0.273419  0.566548  1
  Sm  Sm186  1  0.894801  0.940085  0.566548  1
  Sm  Sm187  1  0.427094  0.398005  0.531444  1
  Sm  Sm188  1  0.927094  0.064671  0.531444  1
  Sm  Sm189  1  0.394801  0.606752  0.566548  1
  Sm  Sm190  1  0.894801  0.273419  0.566548  1
  Sm  Sm191  1  0.927094  0.398005  0.531444  1
  Sm  Sm192  1  0.894801  0.606752  0.566548  1
  Sm  Sm193  1  0.504028  0.717907  0.585629  1
  Sm  Sm194  1  0.471648  0.928160  0.619384  1
  Sm  Sm195  1  0.504028  0.051240  0.585629  1
  Sm  Sm196  1  1.004028  0.717907  0.585629  1
  Sm  Sm197  1  0.471648  0.261493  0.619384  1
  Sm  Sm198  1  0.971648  0.928160  0.619384  1
  Sm  Sm199  1  0.504028  0.384573  0.585629  1
  Sm  Sm200  1  1.004028  0.051240  0.585629  1
  Sm  Sm201  1  0.471648  0.594826  0.619384  1
  Sm  Sm202  1  0.971648  0.261493  0.619384  1
  Sm  Sm203  1  1.004028  0.384573  0.585629  1
  Sm  Sm204  1  0.971648  0.594826  0.619384  1
  Sm  Sm205  1  0.239598  0.978875  0.604342  1
  Sm  Sm206  1  0.267859  0.110816  0.568117  1
  Sm  Sm207  1  0.239598  0.312208  0.604342  1
  Sm  Sm208  1  0.739598  0.978875  0.604342  1
  Sm  Sm209  1  0.267859  0.444150  0.568117  1
  Sm  Sm210  1  0.767859  0.110816  0.568117  1
  Sm  Sm211  1  0.239598  0.645541  0.604342  1
  Sm  Sm212  1  0.739598  0.312208  0.604342  1
  Sm  Sm213  1  0.267859  0.777483  0.568117  1
  Sm  Sm214  1  0.767859  0.444150  0.568117  1
  Sm  Sm215  1  0.739598  0.645541  0.604342  1
  Sm  Sm216  1  0.767859  0.777483  0.568117  1
  Sm  Sm217  1  0.114060  0.155032  0.605323  1
  Sm  Sm218  1  0.143005  0.282398  0.568566  1
  Sm  Sm219  1  0.114060  0.488365  0.605323  1
  Sm  Sm220  1  0.614060  0.155032  0.605323  1
  Sm  Sm221  1  0.143005  0.615731  0.568566  1
  Sm  Sm222  1  0.643005  0.282398  0.568566  1
  Sm  Sm223  1  0.114060  0.821698  0.605323  1
  Sm  Sm224  1  0.614060  0.488365  0.605323  1
  Sm  Sm225  1  0.143005  0.949064  0.568566  1
  Sm  Sm226  1  0.643005  0.615731  0.568566  1
  Sm  Sm227  1  0.614060  0.821698  0.605323  1
  Sm  Sm228  1  0.643005  0.949064  0.568566  1
  Sm  Sm229  1  0.365901  0.812968  0.604194  1
  Sm  Sm230  1  0.330496  0.023570  0.636586  1
  Sm  Sm231  1  0.365901  0.146301  0.604194  1
  Sm  Sm232  1  0.865901  0.812968  0.604194  1
  Sm  Sm233  1  0.330496  0.356903  0.636586  1
  Sm  Sm234  1  0.830496  0.023570  0.636586  1
  Sm  Sm235  1  0.365901  0.479635  0.604194  1
  Sm  Sm236  1  0.865901  0.146301  0.604194  1
  Sm  Sm237  1  0.330496  0.690236  0.636586  1
  Sm  Sm238  1  0.830496  0.356903  0.636586  1
  Sm  Sm239  1  0.865901  0.479635  0.604194  1
  Sm  Sm240  1  0.830496  0.690236  0.636586  1
  Sm  Sm241  1  0.449904  0.796991  0.659894  1
  Sm  Sm242  1  0.406580  1.001873  0.691963  1
  Sm  Sm243  1  0.449904  0.130324  0.659894  1
  Sm  Sm244  1  0.949904  0.796991  0.659894  1
  Sm  Sm245  1  0.406580  0.335207  0.691963  1
  Sm  Sm246  1  0.906580  1.001873  0.691963  1
  Sm  Sm247  1  0.449904  0.463657  0.659894  1
  Sm  Sm248  1  0.949904  0.130324  0.659894  1
  Sm  Sm249  1  0.406580  0.668540  0.691963  1
  Sm  Sm250  1  0.906580  0.335207  0.691963  1
  Sm  Sm251  1  0.949904  0.463657  0.659894  1
  Sm  Sm252  1  0.906580  0.668540  0.691963  1
  Sm  Sm253  1  0.181692  0.048993  0.677561  1
  Sm  Sm254  1  0.204353  0.191523  0.640412  1
  Sm  Sm255  1  0.181692  0.382326  0.677561  1
  Sm  Sm256  1  0.681692  0.048993  0.677561  1
  Sm  Sm257  1  0.204353  0.524856  0.640412  1
  Sm  Sm258  1  0.704353  0.191523  0.640412  1
  Sm  Sm259  1  0.181692  0.715660  0.677561  1
  Sm  Sm260  1  0.681692  0.382326  0.677561  1
  Sm  Sm261  1  0.204353  0.858190  0.640412  1
  Sm  Sm262  1  0.704353  0.524856  0.640412  1
  Sm  Sm263  1  0.681692  0.715660  0.677561  1
  Sm  Sm264  1  0.704353  0.858190  0.640412  1
  Sm  Sm265  1  0.049660  0.234872  0.676529  1
  Sm  Sm266  1  0.081381  0.365433  0.640243  1
  Sm  Sm267  1  0.049660  0.568205  0.676529  1
  Sm  Sm268  1  0.549660  0.234872  0.676529  1
  Sm  Sm269  1  0.081381  0.698766  0.640243  1
  Sm  Sm270  1  0.581381  0.365433  0.640243  1
  Sm  Sm271  1  0.049660  0.901539  0.676529  1
  Sm  Sm272  1  0.549660  0.568205  0.676529  1
  Sm  Sm273  1  0.081381  0.032099  0.640243  1
  Sm  Sm274  1  0.581381  0.698766  0.640243  1
  Sm  Sm275  1  0.549660  0.901539  0.676529  1
  Sm  Sm276  1  0.581381  0.032099  0.640243  1
  Sm  Sm277  1  0.311696  0.893291  0.676206  1
  Sm  Sm278  1  0.265087  0.111545  0.709100  1
  Sm  Sm279  1  0.311696  0.226625  0.676206  1
  Sm  Sm280  1  0.811696  0.893291  0.676206  1
  Sm  Sm281  1  0.265087  0.444878  0.709100  1
  Sm  Sm282  1  0.765087  0.111545  0.709100  1
  Sm  Sm283  1  0.311696  0.559958  0.676206  1
  Sm  Sm284  1  0.811696  0.226625  0.676206  1
  Sm  Sm285  1  0.265087  0.778211  0.709100  1
  Sm  Sm286  1  0.765087  0.444878  0.709100  1
  Sm  Sm287  1  0.811696  0.559958  0.676206  1
  Sm  Sm288  1  0.765087  0.778211  0.709100  1
