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	hartrees
Energy at 0K	-93.256411
Energy at 298.15K	-93.256529
HF Energy	-92.912079
Nuclear repulsion energy	23.979652

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3474	3474	69.60
2	Σ	2199	2199	0.65
3	Π	751	751	35.81
3	Π	751	751	35.81

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.499
H2	0.000	0.000	-1.564
N3	0.000	0.000	0.651

	C1	H2	N3
C1		1.0656	1.1499
H2	1.0656		2.2155
N3	1.1499	2.2155

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

using model chemistry: CCD/Def2TZVPP

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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