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	hartrees
Energy at 0K	-92.916736
Energy at 298.15K	-92.916936
HF Energy	-92.916736
Nuclear repulsion energy	24.487626

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	3605	3275	70.36	15.40	0.25	0.39
2	Σ	2408	2188	10.21	59.53	0.09	0.17
3	Π	878	798	34.97	0.81	0.75	0.86
3	Π	878	798	34.97	0.81	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.486
H2	0.000	0.000	-1.543
N3	0.000	0.000	0.637

	C1	H2	N3
C1		1.0572	1.1233
H2	1.0572		2.1805
N3	1.1233	2.1805

Number	Element	Mulliken
1	C	0.026
2	H	0.150
3	N	-0.176

All results from a given calculation for HCN (Hydrogen cyanide)

using model chemistry: HF/cc-pVQZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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<r²>	13.549
(<r²>)^1/2	3.681