# generated using pymatgen data_Co2P3H11N2O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.43236963 _cell_length_b 5.43236963 _cell_length_c 19.00166600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999554 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co2P3H11N2O9 _chemical_formula_sum 'Co4 P6 H22 N4 O18' _cell_volume 485.62491159 _cell_formula_units_Z 2 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 0.66666700 0.33333300 0.16729800 1.0 Co Co1 1 0.33333300 0.66666700 0.66729800 1.0 Co Co2 1 0.33333300 0.66666700 0.82367400 1.0 Co Co3 1 0.66666700 0.33333300 0.32367400 1.0 P P4 1 0.00000000 0.00000000 0.12761300 1.0 P P5 1 0.00000000 0.00000000 0.62761300 1.0 P P6 1 0.00000000 0.00000000 0.86920200 1.0 P P7 1 0.00000000 0.00000000 0.36920200 1.0 P P8 1 0.33333300 0.66666700 0.26447000 1.0 P P9 1 0.66666700 0.33333300 0.76447000 1.0 H H10 1 0.21556100 0.75406500 0.05244500 1.0 H H11 1 0.24593500 0.46149700 0.05244500 1.0 H H12 1 0.53850300 0.78443900 0.05244500 1.0 H H13 1 0.75406500 0.21556100 0.55244500 1.0 H H14 1 0.78443900 0.53850300 0.55244500 1.0 H H15 1 0.46149700 0.24593500 0.55244500 1.0 H H16 1 0.78374900 0.24543800 0.94881200 1.0 H H17 1 0.75456200 0.53831100 0.94881200 1.0 H H18 1 0.46168900 0.21625100 0.94881200 1.0 H H19 1 0.24543800 0.78374900 0.44881200 1.0 H H20 1 0.21625100 0.46168900 0.44881200 1.0 H H21 1 0.53831100 0.75456200 0.44881200 1.0 H H22 1 0.33333300 0.66666700 0.97861400 1.0 H H23 1 0.66666700 0.33333300 0.47861400 1.0 H H24 1 0.66666700 0.33333300 0.02253500 1.0 H H25 1 0.33333300 0.66666700 0.52253500 1.0 H H26 1 0.00000000 0.00000000 0.20169100 1.0 H H27 1 0.00000000 0.00000000 0.70169100 1.0 H H28 1 0.00000000 0.00000000 0.79507800 1.0 H H29 1 0.00000000 0.00000000 0.29507800 1.0 H H30 1 0.66666700 0.33333300 0.83817100 1.0 H H31 1 0.33333300 0.66666700 0.33817100 1.0 N N32 1 0.33333300 0.66666700 0.03301300 1.0 N N33 1 0.66666700 0.33333300 0.53301300 1.0 N N34 1 0.66666700 0.33333300 0.96814500 1.0 N N35 1 0.33333300 0.66666700 0.46814500 1.0 O O36 1 0.49194800 0.98353600 0.24397400 1.0 O O37 1 0.01646400 0.50841200 0.24397400 1.0 O O38 1 0.49158800 0.50805200 0.24397400 1.0 O O39 1 0.98353600 0.49194800 0.74397400 1.0 O O40 1 0.50805200 0.49158800 0.74397400 1.0 O O41 1 0.50841200 0.01646400 0.74397400 1.0 O O42 1 0.31197200 0.16418900 0.10187600 1.0 O O43 1 0.83581100 0.14778300 0.10187600 1.0 O O44 1 0.85221700 0.68802800 0.10187600 1.0 O O45 1 0.16418900 0.31197200 0.60187600 1.0 O O46 1 0.68802800 0.85221700 0.60187600 1.0 O O47 1 0.14778300 0.83581100 0.60187600 1.0 O O48 1 0.68962000 0.83947100 0.89402500 1.0 O O49 1 0.16052900 0.85015000 0.89402500 1.0 O O50 1 0.14985000 0.31038000 0.89402500 1.0 O O51 1 0.83947100 0.68962000 0.39402500 1.0 O O52 1 0.31038000 0.14985000 0.39402500 1.0 O O53 1 0.85015000 0.16052900 0.39402500 1.0