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	hartrees
Energy at 0K	-93.166940
Energy at 298.15K	-93.167035
HF Energy	-92.870215
Nuclear repulsion energy	23.518003

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	3514	3311	64.10	32.64	0.25	0.40
2	Σ	2046	1928	0.11	21.59	0.24	0.39
3	Π	731	688	38.36	0.01	0.75	0.86
3	Π	731	688	38.36	0.01	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.512
H2	0.000	0.000	-1.581
N3	0.000	0.000	0.664

	C1	H2	N3
C1		1.0690	1.1761
H2	1.0690		2.2451
N3	1.1761	2.2451

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

using model chemistry: MP2=FULL/6-31G*

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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