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	hartrees
Energy at 0K	-93.220569
Energy at 298.15K	-93.220712
HF Energy	-92.882456
Nuclear repulsion energy	23.845533

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3515	3330	60.41
2	Σ	2169	2055	1.00
3	Π	786	745	29.07
3	Π	786	745	29.07

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.502
H2	0.000	0.000	-1.567
N3	0.000	0.000	0.654

	C1	H2	N3
C1		1.0655	1.1553
H2	1.0655		2.2209
N3	1.1553	2.2209

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

using model chemistry: QCISD/6-31G(2df,p)

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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