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	hartrees
Energy at 0K	-93.263250
Energy at 298.15K	-93.263357
HF Energy	-92.909382
Nuclear repulsion energy	23.932205

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3452	3452	66.80
2	Σ	2173	2173	0.62
3	Π	741	741	35.05
3	Π	741	741	35.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.500
H2	0.000	0.000	-1.566
N3	0.000	0.000	0.652

	C1	H2	N3
C1		1.0658	1.1526
H2	1.0658		2.2184
N3	1.1526	2.2184

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

using model chemistry: CCSD/daug-cc-pVTZ

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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