# generated using pymatgen data_CrN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.42800568 _cell_length_b 14.42800568 _cell_length_c 18.46248314 _cell_angle_alpha 61.36311623 _cell_angle_beta 61.36311623 _cell_angle_gamma 37.44372986 _symmetry_Int_Tables_number 1 _chemical_formula_structural CrN2 _chemical_formula_sum 'Cr28 N56' _cell_volume 2015.39362038 _cell_formula_units_Z 28 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 0.47326000 0.84267300 0.60087200 1.0 Cr Cr1 1 0.84267300 0.47326000 0.60087200 1.0 Cr Cr2 1 0.52674000 0.15732700 0.39912800 1.0 Cr Cr3 1 0.15732700 0.52674000 0.39912800 1.0 Cr Cr4 1 0.54886000 0.92258200 0.22403400 1.0 Cr Cr5 1 0.92258200 0.54886000 0.22403400 1.0 Cr Cr6 1 0.45114000 0.07741800 0.77596600 1.0 Cr Cr7 1 0.07741800 0.45114000 0.77596600 1.0 Cr Cr8 1 0.99283800 0.62072300 0.90777400 1.0 Cr Cr9 1 0.62072300 0.99283800 0.90777400 1.0 Cr Cr10 1 0.00716200 0.37927700 0.09222600 1.0 Cr Cr11 1 0.37927700 0.00716200 0.09222600 1.0 Cr Cr12 1 0.96703100 0.59675800 0.59590500 1.0 Cr Cr13 1 0.59675800 0.96703100 0.59590500 1.0 Cr Cr14 1 0.03296900 0.40324200 0.40409500 1.0 Cr Cr15 1 0.40324200 0.03296900 0.40409500 1.0 Cr Cr16 1 0.23635600 0.60779500 0.91409900 1.0 Cr Cr17 1 0.60779500 0.23635600 0.91409900 1.0 Cr Cr18 1 0.76364400 0.39220500 0.08590100 1.0 Cr Cr19 1 0.39220500 0.76364400 0.08590100 1.0 Cr Cr20 1 0.18683900 0.56052200 0.11781100 1.0 Cr Cr21 1 0.56052200 0.18683900 0.11781100 1.0 Cr Cr22 1 0.81316100 0.43947800 0.88218900 1.0 Cr Cr23 1 0.43947800 0.81316100 0.88218900 1.0 Cr Cr24 1 0.24206600 0.86990500 0.78427800 1.0 Cr Cr25 1 0.86990500 0.24206600 0.78427800 1.0 Cr Cr26 1 0.75793400 0.13009500 0.21572200 1.0 Cr Cr27 1 0.13009500 0.75793400 0.21572200 1.0 N N28 1 0.73408100 0.73408100 0.21979400 1.0 N N29 1 0.26591900 0.26591900 0.78020600 1.0 N N30 1 0.84362600 0.33460900 0.83664100 1.0 N N31 1 0.33460900 0.84362600 0.83664100 1.0 N N32 1 0.15637400 0.66539100 0.16335900 1.0 N N33 1 0.66539100 0.15637400 0.16335900 1.0 N N34 1 0.80868800 0.80868800 0.91434400 1.0 N N35 1 0.19131200 0.19131200 0.08565600 1.0 N N36 1 0.83023900 0.35582000 0.98644800 1.0 N N37 1 0.35582000 0.83023900 0.98644800 1.0 N N38 1 0.16976100 0.64418000 0.01355200 1.0 N N39 1 0.64418000 0.16976100 0.01355200 1.0 N N40 1 0.50000000 0.00000000 0.00000000 1.0 N N41 1 0.00000000 0.50000000 0.00000000 1.0 N N42 1 0.42277200 0.42277200 0.91166800 1.0 N N43 1 0.57722800 0.57722800 0.08833200 1.0 N N44 1 0.50771600 0.06360400 0.38423600 1.0 N N45 1 0.06360400 0.50771600 0.38423600 1.0 N N46 1 0.49228400 0.93639600 0.61576400 1.0 N N47 1 0.93639600 0.49228400 0.61576400 1.0 N N48 1 0.05364600 0.53399600 0.67257400 1.0 N N49 1 0.53399600 0.05364600 0.67257400 1.0 N N50 1 0.94635400 0.46600400 0.32742600 1.0 N N51 1 0.46600400 0.94635400 0.32742600 1.0 N N52 1 0.26162000 0.76485300 0.16296500 1.0 N N53 1 0.76485300 0.26162000 0.16296500 1.0 N N54 1 0.73838000 0.23514700 0.83703500 1.0 N N55 1 0.23514700 0.73838000 0.83703500 1.0 N N56 1 0.56068000 0.05012300 0.16912800 1.0 N N57 1 0.05012300 0.56068000 0.16912800 1.0 N N58 1 0.43932000 0.94987700 0.83087200 1.0 N N59 1 0.94987700 0.43932000 0.83087200 1.0 N N60 1 0.94514100 0.94514100 0.21789400 1.0 N N61 1 0.05485900 0.05485900 0.78210600 1.0 N N62 1 0.37214400 0.37214400 0.12466000 1.0 N N63 1 0.62785600 0.62785600 0.87534000 1.0 N N64 1 0.15263500 0.65735300 0.31822500 1.0 N N65 1 0.65735300 0.15263500 0.31822500 1.0 N N66 1 0.84736500 0.34264700 0.68177500 1.0 N N67 1 0.34264700 0.84736500 0.68177500 1.0 N N68 1 0.42178300 0.92381800 0.50403400 1.0 N N69 1 0.92381800 0.42178300 0.50403400 1.0 N N70 1 0.57821700 0.07618200 0.49596600 1.0 N N71 1 0.07618200 0.57821700 0.49596600 1.0 N N72 1 0.78936700 0.78936700 0.59531900 1.0 N N73 1 0.21063300 0.21063300 0.40468100 1.0 N N74 1 0.43853600 0.96450900 0.17541400 1.0 N N75 1 0.96450900 0.43853600 0.17541400 1.0 N N76 1 0.56146400 0.03549100 0.82458600 1.0 N N77 1 0.03549100 0.56146400 0.82458600 1.0 N N78 1 0.65278700 0.65278700 0.59915700 1.0 N N79 1 0.34721300 0.34721300 0.40084300 1.0 N N80 1 0.12480200 0.61271700 0.89710200 1.0 N N81 1 0.61271700 0.12480200 0.89710200 1.0 N N82 1 0.87519800 0.38728300 0.10289800 1.0 N N83 1 0.38728300 0.87519800 0.10289800 1.0