# generated using pymatgen data_CoH8C4(NO2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.52757500 _cell_length_b 8.84481900 _cell_length_c 12.02564000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CoH8C4(NO2)3 _chemical_formula_sum 'Co4 H32 C16 N12 O24' _cell_volume 907.03218195 _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 Co Co0 1 0.24978800 0.25079000 0.75037900 1.0 Co Co1 1 0.25021200 0.24921000 0.25037900 1.0 Co Co2 1 0.75021200 0.75079000 0.25037900 1.0 Co Co3 1 0.74978800 0.74921000 0.75037900 1.0 H H4 1 0.90748500 0.07342200 0.78567900 1.0 H H5 1 0.59723300 0.07244800 0.21362500 1.0 H H6 1 0.90276700 0.42755200 0.71362500 1.0 H H7 1 0.59251500 0.42657800 0.28567900 1.0 H H8 1 0.09723300 0.92755200 0.21362500 1.0 H H9 1 0.40748500 0.92657800 0.78567900 1.0 H H10 1 0.09251500 0.57342200 0.28567900 1.0 H H11 1 0.40276700 0.57244800 0.71362500 1.0 H H12 1 0.17039700 0.93114500 0.91867400 1.0 H H13 1 0.33081200 0.93240500 0.08076300 1.0 H H14 1 0.16918800 0.56759500 0.58076300 1.0 H H15 1 0.32960300 0.56885500 0.41867400 1.0 H H16 1 0.83081200 0.06759500 0.08076300 1.0 H H17 1 0.67039700 0.06885500 0.91867400 1.0 H H18 1 0.82960300 0.43114500 0.41867400 1.0 H H19 1 0.66918800 0.43240500 0.58076300 1.0 H H20 1 0.08568600 0.75275600 0.87768700 1.0 H H21 1 0.41493200 0.75521300 0.12334700 1.0 H H22 1 0.08506800 0.74478700 0.62334700 1.0 H H23 1 0.41431400 0.74724400 0.37768700 1.0 H H24 1 0.91493200 0.24478700 0.12334700 1.0 H H25 1 0.58568600 0.24724400 0.87768700 1.0 H H26 1 0.91431400 0.25275600 0.37768700 1.0 H H27 1 0.58506800 0.25521300 0.62334700 1.0 H H28 1 0.24757800 0.32619000 0.99884400 1.0 H H29 1 0.25242200 0.17381000 0.49884400 1.0 H H30 1 0.74757800 0.67381000 0.99884400 1.0 H H31 1 0.75242200 0.82619000 0.49884400 1.0 H H32 1 0.32657900 0.54176700 0.05153600 1.0 H H33 1 0.17342100 0.95823300 0.55153600 1.0 H H34 1 0.82657900 0.45823300 0.05153600 1.0 H H35 1 0.67342100 0.04176700 0.55153600 1.0 C C36 1 0.24934900 0.74150100 0.00074400 1.0 C C37 1 0.25065100 0.75849900 0.50074400 1.0 C C38 1 0.74934900 0.25849900 0.00074400 1.0 C C39 1 0.75065100 0.24150100 0.50074400 1.0 C C40 1 0.98047200 0.01430700 0.72310200 1.0 C C41 1 0.51995500 0.01580300 0.27524100 1.0 C C42 1 0.98004500 0.48419700 0.77524100 1.0 C C43 1 0.51952800 0.48569300 0.22310200 1.0 C C44 1 0.01995500 0.98419700 0.27524100 1.0 C C45 1 0.48047200 0.98569300 0.72310200 1.0 C C46 1 0.01952800 0.51430700 0.22310200 1.0 C C47 1 0.48004500 0.51580300 0.77524100 1.0 C C48 1 0.25012700 0.20185500 0.99954800 1.0 C C49 1 0.24987300 0.29814500 0.49954800 1.0 C C50 1 0.75012700 0.79814500 0.99954800 1.0 C C51 1 0.74987300 0.70185500 0.49954800 1.0 N N52 1 0.23516600 0.58911600 0.00648600 1.0 N N53 1 0.26483400 0.91088400 0.50648600 1.0 N N54 1 0.73516600 0.41088400 0.00648600 1.0 N N55 1 0.76483400 0.08911600 0.50648600 1.0 N N56 1 0.16061500 0.81552600 0.92647300 1.0 N N57 1 0.34189700 0.81678200 0.07230400 1.0 N N58 1 0.15810300 0.68321800 0.57230400 1.0 N N59 1 0.33938500 0.68447400 0.42647300 1.0 N N60 1 0.84189700 0.18321800 0.07230400 1.0 N N61 1 0.66061500 0.18447400 0.92647300 1.0 N N62 1 0.83938500 0.31552600 0.42647300 1.0 N N63 1 0.65810300 0.31678200 0.57230400 1.0 O O64 1 0.10233600 0.08049300 0.68648500 1.0 O O65 1 0.39931800 0.08493600 0.30848900 1.0 O O66 1 0.10068200 0.41506400 0.80848900 1.0 O O67 1 0.39766400 0.41950700 0.18648500 1.0 O O68 1 0.89931800 0.91506400 0.30848900 1.0 O O69 1 0.60233600 0.91950700 0.68648500 1.0 O O70 1 0.89766400 0.58049300 0.18648500 1.0 O O71 1 0.60068200 0.58493600 0.80848900 1.0 O O72 1 0.93845800 0.88291300 0.69276000 1.0 O O73 1 0.55913900 0.88342800 0.30667600 1.0 O O74 1 0.94086100 0.61657200 0.80667600 1.0 O O75 1 0.56154200 0.61708700 0.19276000 1.0 O O76 1 0.05913900 0.11657200 0.30667600 1.0 O O77 1 0.43845800 0.11708700 0.69276000 1.0 O O78 1 0.06154200 0.38291300 0.19276000 1.0 O O79 1 0.44086100 0.38342800 0.80667600 1.0 O O80 1 0.24326500 0.13346300 0.90609700 1.0 O O81 1 0.25856400 0.13386000 0.09266100 1.0 O O82 1 0.24143600 0.36614000 0.59266100 1.0 O O83 1 0.25673500 0.36653700 0.40609700 1.0 O O84 1 0.75856400 0.86614000 0.09266100 1.0 O O85 1 0.74326500 0.86653700 0.90609700 1.0 O O86 1 0.75673500 0.63346300 0.40609700 1.0 O O87 1 0.74143600 0.63386000 0.59266100 1.0