# generated using pymatgen data_Sm9YC4I15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.61472669 _cell_length_b 10.47369173 _cell_length_c 11.56621372 _cell_angle_alpha 93.44740453 _cell_angle_beta 114.13230882 _cell_angle_gamma 109.67181497 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm9YC4I15 _chemical_formula_sum 'Sm9 Y1 C4 I15' _cell_volume 974.04106361 _cell_formula_units_Z 1 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 Sm0 1 0.34494354 0.74208438 0.16213101 1.0 Sm Sm1 1 0.77306176 0.88032057 0.25506060 1.0 Sm Sm2 1 0.52858718 0.18616658 0.10347430 1.0 Sm Sm3 1 0.22712179 0.11945425 0.74505060 1.0 Sm Sm4 1 0.40482298 0.46116133 0.65834054 1.0 Sm Sm5 1 0.47255644 0.81368920 0.89707352 1.0 Sm Sm6 1 0.70165526 0.56749179 0.04386152 1.0 Sm Sm7 1 0.29823616 0.43243481 0.95602733 1.0 Sm Sm8 1 0.65490184 0.25851262 0.83596866 1.0 Y Y9 1 0.59326665 0.54109648 0.33858366 1.0 C C10 1 0.48356319 0.30088040 0.94008917 1.0 C C11 1 0.51714856 0.69871304 0.06028957 1.0 C C12 1 0.45392837 0.36534692 0.83392333 1.0 C C13 1 0.54595472 0.63428925 0.16667373 1.0 I I14 1 0.20792822 0.90557867 0.93779285 1.0 I I15 1 0.10487611 0.18949822 0.46802808 1.0 I I16 1 0.15195008 0.55648632 0.70147807 1.0 I I17 1 0.40892846 0.97243716 0.64888130 1.0 I I18 1 0.71532301 0.73749740 0.81969936 1.0 I I19 1 0.29042392 0.26589461 0.18433155 1.0 I I20 1 0.84394066 0.44556322 0.30145897 1.0 I I21 1 0.89051222 0.80539444 0.52981276 1.0 I I22 1 0.35967183 0.62703876 0.41250598 1.0 I I23 1 0.05250250 0.83222330 0.22103746 1.0 I I24 1 0.79297944 0.09535427 0.06221353 1.0 I I25 1 0.64234781 0.37338641 0.58327825 1.0 I I26 1 0.94801584 0.16581391 0.78083554 1.0 I I27 1 0.59054155 0.02723041 0.35083670 1.0 I I28 1 0.00030888 0.49895727 0.00126305 1.0