# generated using pymatgen data_Tb12(MnC3)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.08161093 _cell_length_b 10.49989466 _cell_length_c 10.50339395 _cell_angle_alpha 120.01116590 _cell_angle_beta 90.00000083 _cell_angle_gamma 89.99999917 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb12(MnC3)5 _chemical_formula_sum 'Tb12 Mn5 C15' _cell_volume 485.28600107 _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 Tb Tb0 1 0.50000001 0.20671096 0.20700147 1.0 Tb Tb1 1 0.50000003 0.00000050 0.79042416 1.0 Tb Tb2 1 0.49999999 0.79329175 0.00029603 1.0 Tb Tb3 1 -0.00000003 0.73120813 0.18616520 1.0 Tb Tb4 1 -0.00000001 0.45559871 0.26937249 1.0 Tb Tb5 1 -0.00000000 0.54440939 0.81378109 1.0 Tb Tb6 1 0.00000003 0.81383709 0.54456761 1.0 Tb Tb7 1 0.00000005 0.18615961 0.73073192 1.0 Tb Tb8 1 -0.00000003 0.26879341 0.45495269 1.0 Tb Tb9 1 0.49999998 0.57311274 0.57241580 1.0 Tb Tb10 1 0.49999995 -0.00000693 0.43025446 1.0 Tb Tb11 1 0.50000002 0.42689223 0.99931280 1.0 Mn Mn12 1 0.00000001 0.84463566 0.84529463 1.0 Mn Mn13 1 -0.00000003 -0.00000398 0.15475301 1.0 Mn Mn14 1 0.00000001 0.15535882 0.00065563 1.0 Mn Mn15 1 0.50000001 0.66605060 0.33287202 1.0 Mn Mn16 1 0.50000002 0.33395089 0.66682183 1.0 C C17 1 0.00000001 0.67293692 0.67255577 1.0 C C18 1 0.00000001 -0.00000201 0.32680773 1.0 C C19 1 -0.00000003 0.32706558 0.99962329 1.0 C C20 1 -0.00000000 0.20583138 0.20547520 1.0 C C21 1 0.00000006 -0.00000250 0.79735638 1.0 C C22 1 -0.00000003 0.79417095 0.99964692 1.0 C C23 1 -0.00000003 0.54459249 0.54411389 1.0 C C24 1 0.00000000 -0.00000314 0.45527708 1.0 C C25 1 0.00000002 0.45540371 -0.00047689 1.0 C C26 1 0.49999997 0.71716476 0.19692953 1.0 C C27 1 0.49999999 0.47870157 0.28200418 1.0 C C28 1 0.50000001 0.52129913 0.80330569 1.0 C C29 1 0.50000000 0.80394677 0.52094341 1.0 C C30 1 0.50000001 0.19605599 0.71699775 1.0 C C31 1 0.49999999 0.28283879 0.47976723 1.0