# generated using pymatgen data_Ho2Ni22C3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.35548341 _cell_length_b 9.35548341 _cell_length_c 14.50080828 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 105.63332353 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho2Ni22C3 _chemical_formula_sum 'Ho8 Ni88 C12' _cell_volume 1222.23205305 _cell_formula_units_Z 4 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 Ho Ho0 1 0.81507536 0.68492464 0.25000000 1.0 Ho Ho1 1 0.68492464 0.81507536 0.75000000 1.0 Ho Ho2 1 0.18492464 0.31507536 0.75000000 1.0 Ho Ho3 1 0.31507536 0.18492464 0.25000000 1.0 Ho Ho4 1 0.70682286 0.29317714 0.52840340 1.0 Ho Ho5 1 0.29317714 0.70682286 0.47159660 1.0 Ho Ho6 1 0.79317714 0.20682286 0.02840340 1.0 Ho Ho7 1 0.20682286 0.79317714 0.97159660 1.0 Ni Ni8 1 0.92860046 0.43000025 0.18146854 1.0 Ni Ni9 1 0.43000025 0.92860046 0.81853146 1.0 Ni Ni10 1 0.93000025 0.42860046 0.68146854 1.0 Ni Ni11 1 0.42860046 0.93000025 0.31853146 1.0 Ni Ni12 1 0.07139954 0.56999975 0.81853146 1.0 Ni Ni13 1 0.56999975 0.07139954 0.18146854 1.0 Ni Ni14 1 0.06999975 0.57139954 0.31853146 1.0 Ni Ni15 1 0.57139954 0.06999975 0.68146854 1.0 Ni Ni16 1 0.56103343 0.43896657 0.34211077 1.0 Ni Ni17 1 0.43896657 0.56103343 0.65788923 1.0 Ni Ni18 1 0.93896657 0.06103343 0.84211077 1.0 Ni Ni19 1 0.06103343 0.93896657 0.15788923 1.0 Ni Ni20 1 0.00869881 0.76885783 0.42142476 1.0 Ni Ni21 1 0.76885783 0.00869881 0.57857524 1.0 Ni Ni22 1 0.26885783 0.50869881 0.92142476 1.0 Ni Ni23 1 0.50869881 0.26885783 0.07857524 1.0 Ni Ni24 1 0.99130119 0.23114217 0.57857524 1.0 Ni Ni25 1 0.23114217 0.99130119 0.42142476 1.0 Ni Ni26 1 0.73114217 0.49130119 0.07857524 1.0 Ni Ni27 1 0.49130119 0.73114217 0.92142476 1.0 Ni Ni28 1 0.75246546 0.59754544 0.45033294 1.0 Ni Ni29 1 0.59754544 0.75246546 0.54966706 1.0 Ni Ni30 1 0.09754544 0.25246546 0.95033294 1.0 Ni Ni31 1 0.25246546 0.09754544 0.04966706 1.0 Ni Ni32 1 0.24753454 0.40245456 0.54966706 1.0 Ni Ni33 1 0.40245456 0.24753454 0.45033294 1.0 Ni Ni34 1 0.90245456 0.74753454 0.04966706 1.0 Ni Ni35 1 0.74753454 0.90245456 0.95033294 1.0 Ni Ni36 1 0.14065907 0.21174523 0.42679819 1.0 Ni Ni37 1 0.21174523 0.14065907 0.57320181 1.0 Ni Ni38 1 0.71174523 0.64065907 0.92679819 1.0 Ni Ni39 1 0.64065907 0.71174523 0.07320181 1.0 Ni Ni40 1 0.85934093 0.78825477 0.57320181 1.0 Ni Ni41 1 0.78825477 0.85934093 0.42679819 1.0 Ni Ni42 1 0.28825477 0.35934093 0.07320181 1.0 Ni Ni43 1 0.35934093 0.28825477 0.92679819 1.0 Ni Ni44 1 0.82056325 0.39582784 0.34374873 1.0 Ni Ni45 1 0.39582784 0.82056325 0.65625127 1.0 Ni Ni46 1 0.89582784 0.32056325 0.84374873 1.0 Ni Ni47 1 0.32056325 0.89582784 0.15625127 1.0 Ni Ni48 1 0.17943675 0.60417216 0.65625127 1.0 Ni Ni49 1 0.60417216 0.17943675 0.34374873 1.0 Ni Ni50 1 0.10417216 0.67943675 0.15625127 1.0 Ni Ni51 1 0.67943675 0.10417216 0.84374873 1.0 Ni Ni52 1 0.94919721 0.79712148 0.86950440 1.0 Ni Ni53 1 0.79712148 0.94919721 0.13049560 1.0 Ni Ni54 1 0.29712148 0.44919721 0.36950440 1.0 Ni Ni55 1 0.44919721 0.29712148 0.63049560 1.0 Ni Ni56 1 0.05080279 0.20287852 0.13049560 1.0 Ni Ni57 1 0.20287852 0.05080279 0.86950440 1.0 Ni Ni58 1 0.70287852 0.55080279 0.63049560 1.0 Ni Ni59 1 0.55080279 0.70287852 0.36950440 1.0 Ni Ni60 1 0.04639804 0.29299005 0.29847658 1.0 Ni Ni61 1 0.29299005 0.04639804 0.70152342 1.0 Ni Ni62 1 0.79299005 0.54639804 0.79847658 1.0 Ni Ni63 1 0.54639804 0.79299005 0.20152342 1.0 Ni Ni64 1 0.95360196 0.70700995 0.70152342 1.0 Ni Ni65 1 0.70700995 0.95360196 0.29847658 1.0 Ni Ni66 1 0.20700995 0.45360196 0.20152342 1.0 Ni Ni67 1 0.45360196 0.20700995 0.79847658 1.0 Ni Ni68 1 0.81915981 0.18084019 0.23270694 1.0 Ni Ni69 1 0.18084019 0.81915981 0.76729306 1.0 Ni Ni70 1 0.68084019 0.31915981 0.73270694 1.0 Ni Ni71 1 0.31915981 0.68084019 0.26729306 1.0 Ni Ni72 1 0.85538359 0.14461641 0.41381876 1.0 Ni Ni73 1 0.14461641 0.85538359 0.58618124 1.0 Ni Ni74 1 0.64461641 0.35538359 0.91381876 1.0 Ni Ni75 1 0.35538359 0.64461641 0.08618124 1.0 Ni Ni76 1 0.99792803 0.00207197 0.32515524 1.0 Ni Ni77 1 0.00207197 0.99792803 0.67484476 1.0 Ni Ni78 1 0.50207197 0.49792803 0.82515524 1.0 Ni Ni79 1 0.49792803 0.50207197 0.17484476 1.0 Ni Ni80 1 0.65839801 0.34160199 0.21172258 1.0 Ni Ni81 1 0.34160199 0.65839801 0.78827742 1.0 Ni Ni82 1 0.84160199 0.15839801 0.71172258 1.0 Ni Ni83 1 0.15839801 0.84160199 0.28827742 1.0 Ni Ni84 1 -0.00000000 0.00000000 0.50000000 1.0 Ni Ni85 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni86 1 0.09273681 0.47167816 0.04816046 1.0 Ni Ni87 1 0.47167816 0.09273681 0.95183954 1.0 Ni Ni88 1 0.97167816 0.59273681 0.54816046 1.0 Ni Ni89 1 0.59273681 0.97167816 0.45183954 1.0 Ni Ni90 1 0.90726319 0.52832184 0.95183954 1.0 Ni Ni91 1 0.52832184 0.90726319 0.04816046 1.0 Ni Ni92 1 0.02832184 0.40726319 0.45183954 1.0 Ni Ni93 1 0.40726319 0.02832184 0.54816046 1.0 Ni Ni94 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni95 1 -0.00000000 0.00000000 0.00000000 1.0 C C96 1 0.94502233 0.05497767 0.21111420 1.0 C C97 1 0.05497767 0.94502233 0.78888580 1.0 C C98 1 0.55497767 0.44502233 0.71111420 1.0 C C99 1 0.44502233 0.55497767 0.28888580 1.0 C C100 1 0.93173095 0.55760204 0.41616886 1.0 C C101 1 0.55760204 0.93173095 0.58383114 1.0 C C102 1 0.05760204 0.43173095 0.91616886 1.0 C C103 1 0.43173095 0.05760204 0.08383114 1.0 C C104 1 0.06826905 0.44239796 0.58383114 1.0 C C105 1 0.44239796 0.06826905 0.41616886 1.0 C C106 1 0.94239796 0.56826905 0.08383114 1.0 C C107 1 0.56826905 0.94239796 0.91616886 1.0