# generated using pymatgen data_CrN3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.03231800 _cell_length_b 10.07583000 _cell_length_c 10.11658400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CrN3O8 _chemical_formula_sum 'Cr4 N12 O32' _cell_volume 818.75811458 _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 Cr Cr0 1 0.34707400 0.99925000 0.25328500 1.0 Cr Cr1 1 0.84707400 0.50075000 0.25328500 1.0 Cr Cr2 1 0.84707400 0.00075000 0.74671500 1.0 Cr Cr3 1 0.34707400 0.49925000 0.74671500 1.0 N N4 1 0.10734500 0.26889900 0.01144300 1.0 N N5 1 0.60734500 0.23110100 0.01144300 1.0 N N6 1 0.10975900 0.25403500 0.48928400 1.0 N N7 1 0.10734500 0.76889900 0.98855700 1.0 N N8 1 0.10975900 0.75403500 0.51071600 1.0 N N9 1 0.33470500 0.48418000 0.25798000 1.0 N N10 1 0.60975900 0.74596500 0.51071600 1.0 N N11 1 0.60975900 0.24596500 0.48928400 1.0 N N12 1 0.83470500 0.01582000 0.25798000 1.0 N N13 1 0.60734500 0.73110100 0.98855700 1.0 N N14 1 0.83470500 0.51582000 0.74202000 1.0 N N15 1 0.33470500 0.98418000 0.74202000 1.0 O O16 1 0.37241800 0.99770600 0.05900200 1.0 O O17 1 0.51273700 0.95672900 0.11540900 1.0 O O18 1 0.34153600 0.00091100 0.44940900 1.0 O O19 1 0.49788000 0.98674500 0.40914500 1.0 O O20 1 0.38387800 0.19373600 0.24550500 1.0 O O21 1 0.29143300 0.80890600 0.26562900 1.0 O O22 1 0.22164900 0.16987600 0.24694700 1.0 O O23 1 0.15617700 0.87838200 0.23337200 1.0 O O24 1 0.84153600 0.49908900 0.44940900 1.0 O O25 1 0.99788000 0.51325500 0.40914500 1.0 O O26 1 0.87241800 0.50229400 0.05900200 1.0 O O27 1 0.01273700 0.54327100 0.11540900 1.0 O O28 1 0.79143300 0.69109400 0.26562900 1.0 O O29 1 0.65617700 0.62161800 0.23337200 1.0 O O30 1 0.88387800 0.30626400 0.24550500 1.0 O O31 1 0.72164900 0.33012400 0.24694700 1.0 O O32 1 0.72164900 0.83012400 0.75305300 1.0 O O33 1 0.88387800 0.80626400 0.75449500 1.0 O O34 1 0.84153600 0.99908900 0.55059100 1.0 O O35 1 0.99788000 0.01325500 0.59085500 1.0 O O36 1 0.87241800 0.00229400 0.94099800 1.0 O O37 1 0.01273700 0.04327100 0.88459100 1.0 O O38 1 0.79143300 0.19109400 0.73437100 1.0 O O39 1 0.65617700 0.12161800 0.76662800 1.0 O O40 1 0.29143300 0.30890600 0.73437100 1.0 O O41 1 0.15617700 0.37838200 0.76662800 1.0 O O42 1 0.38387800 0.69373600 0.75449500 1.0 O O43 1 0.22164900 0.66987600 0.75305300 1.0 O O44 1 0.51273700 0.45672900 0.88459100 1.0 O O45 1 0.37241800 0.49770600 0.94099800 1.0 O O46 1 0.49788000 0.48674500 0.59085500 1.0 O O47 1 0.34153600 0.50091100 0.55059100 1.0