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	hartrees
Energy at 0K	-92.931236
Energy at 298.15K
HF Energy	-92.931236
Nuclear repulsion energy	23.957512

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3354	3354	74.87
2	Σ	2161	2161	0.64
3	Π	724	724	36.78
3	Π	724	724	36.78

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.497
H2	0.000	0.000	-1.575
N3	0.000	0.000	0.651

	C1	H2	N3
C1		1.0772	1.1488
H2	1.0772		2.2260
N3	1.1488	2.2260

Number	Element	Mulliken
1	C	-0.057
2	H	0.151
3	N	-0.094

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

using model chemistry: LSDA/cc-pCVQZ

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>	13.880
(<r²>)^1/2	3.726