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	hartrees
Energy at 0K	-93.253093
Energy at 298.15K	-93.253195
HF Energy	-92.904986
Nuclear repulsion energy	23.708003

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	3465	3269	78.36	33.77	0.19	0.32
2	Σ	2030	1915	0.20	42.70	0.08	0.15
3	Π	731	690	36.59	0.21	0.75	0.86
3	Π	731	690	36.59	0.21	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.507
H2	0.000	0.000	-1.572
N3	0.000	0.000	0.659

	C1	H2	N3
C1		1.0657	1.1655
H2	1.0657		2.2313
N3	1.1655	2.2313

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

using model chemistry: MP2/6-311+G(3df,2p)

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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